SCHEMBL18787255

SCHEMBL18787255

CCc1cc(OCc2ccccc2)c(F)cc1[B-](F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.43
▸ BRD4 O60885 2/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MRGPRX4 Q96LA9 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PTGER1 P34995 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ S1PR5 Q9H228 1/20 0.39
▸ CTSV O60911 1/20 0.39
▸ CTSL P07711 1/20 0.39
▸ KDM1A O60341 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30437072 1.00 NPC1 (0.43) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL28334988 0.82 NPC1 (0.42) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL17258686 0.80 MEN1 (0.44) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL29564439 0.80 MEN1 (0.44) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL28334986 0.77 GAA (0.42) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL18787256 0.75 KDM1A (0.45) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL23663364 0.74 FFAR1 (0.47) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL28332769 0.74 KDM1A (0.44) NPC1BRD4MAPK1MAPTTDP1
SCHEMBL29703994 0.73 KDM1A (0.48) NPC1MAPK1MAPTTDP1L3MBTL1
SCHEMBL18787264 0.73 KDM1A (0.48) NPC1MAPK1MAPTTDP1L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11786517-B2 Methods of treatment using a JAK inhibitor compound THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-10-17 — — US disclosed
US-11718616-B2 JAK kinase inhibitor compounds for treatment of respiratory disease THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-08-08 — — US disclosed
EP-3619208-B1 CRYSTALLINE FORMS OF A JAK INHIBITOR COMPOUND THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-06-07 — — EP disclosed
US-20220306624-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-09-29 — — US disclosed
US-11299492-B2 JAK kinase inhibitor compounds for treatment of respiratory disease THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-04-12 — — US disclosed
US-20220008403-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-01-13 — — US disclosed
US-11160800-B2 Methods of treatment using a JAK inhibitor compound THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-11-02 — — US disclosed
US-20210130351-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-05-06 — — US disclosed
US-10913740-B2 JAK kinase inhibitor compounds for treatment of respiratory disease THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-02-09 — — US disclosed
US-20200121669-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-04-23 — — US disclosed
US-10251874-B2 Crystalline forms of a JAK inhibitor compound THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-04-09 — — US disclosed
US-10183942-B2 JAK kinase inhibitor compounds for treatment of respiratory disease THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-01-22 — — US disclosed
US-20180319796-A1 JAK Kinase Inhibitor Compounds for Treatment of Respiratory Disease THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-11-08 — — US disclosed
WO-2018204236-A1 CRYSTALLINE FORMS OF A JAK INHIBITOR COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-11-08 — — WO disclosed
US-20180311223-A1 CRYSTALLINE FORMS OF A JAK INHIBITOR COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-11-01 — — US disclosed
US-20180311226-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-11-01 — — US disclosed
US-10100049-B2 JAK kinase inhibitor compounds for treatment of respiratory disease THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-10-16 — — US disclosed
EP-3371186-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE Theravance Biopharma R&D IP, LLC (US) 2018-09-12 — — EP disclosed
WO-2017079205-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-05-11 — — WO disclosed
US-20170121327-A1 JAK Kinase Inhibitor Compounds for Treatment of Respiratory Disease THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-05-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (16 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10913740-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-11299492-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-11718616-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-11786517-B2 Methods of treatment using a JAK inhibitor compound JAK1, JAK2, JAK3 NPC1 1577/4885BRD4 28/4885MAPK1 146/4885
US-20180311223-A1 CRYSTALLINE FORMS OF A JAK INHIBITOR COMPOUND JAK1, JAK2, JAK3 NPC1 3708/4885BRD4 1251/4885MAPK1 278/4885
US-20220306624-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-20210130351-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-20220008403-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND JAK1, JAK2, JAK3 NPC1 1577/4885BRD4 28/4885MAPK1 146/4885
US-20200121669-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND JAK1, JAK2, JAK3 NPC1 1577/4885BRD4 28/4885MAPK1 146/4885
US-20180319796-A1 JAK Kinase Inhibitor Compounds for Treatment of Respiratory Disease JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-20170121327-A1 JAK Kinase Inhibitor Compounds for Treatment of Respiratory Disease JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-11160800-B2 Methods of treatment using a JAK inhibitor compound JAK1, JAK2, JAK3 NPC1 1577/4885BRD4 28/4885MAPK1 146/4885
US-10183942-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885
US-20180311226-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND JAK1, JAK2, JAK3 NPC1 1577/4885BRD4 28/4885MAPK1 146/4885
US-10251874-B2 Crystalline forms of a JAK inhibitor compound JAK1, JAK2, JAK3 NPC1 3708/4885BRD4 1251/4885MAPK1 278/4885
US-10100049-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 NPC1 2148/4885BRD4 488/4885MAPK1 57/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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