SCHEMBL18787256

SCHEMBL18787256

CCc1ccc(F)c(OCc2ccccc2)c1.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 4/20 0.45
▸ MAPK1 P28482 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ MRGPRX4 Q96LA9 1/20 0.43
▸ PTGER1 P34995 1/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ LIPE Q05469 1/20 0.41
▸ FOLH1 Q04609 1/20 0.40

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
SCHEMBL28332769 0.98 KDM1A (0.44) KDM1AMAPK1MAPTTDP1L3MBTL1
SCHEMBL18787264 0.95 KDM1A (0.48) KDM1AMAPK1MAPTTDP1L3MBTL1
SCHEMBL29703994 0.95 KDM1A (0.48) KDM1AMAPK1MAPTTDP1L3MBTL1
SCHEMBL28182366 0.83 KDM1A (0.46) KDM1AMAPK1MAPTTDP1L3MBTL1
SCHEMBL13753876 0.80 MEN1 (0.56) MAPK1MAPTTDP1L3MBTL1MEN1
SCHEMBL3168485 0.80 CYP4F2 (0.51) KDM1AMAPK1MAPTTDP1L3MBTL1
SCHEMBL9454115 0.80 MRGPRX4 (0.46) KDM1AMAPK1MAPTTDP1L3MBTL1
Ammonia Solution, Strong SCHEMBL11688841 0.79 MEN1 (0.55) MAPK1MAPTTDP1L3MBTL1MEN1
SCHEMBL31473328 0.78 KDM1A (0.44) KDM1AMAPK1MAPTTDP1L3MBTL1
SCHEMBL17367259 0.78 MAPT (0.53) KDM1AMAPK1MAPTTDP1L3MBTL1

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 27 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
CN-108349972-B JAK kinase inhibitor compounds for the treatment of respiratory diseases 施万生物制药研发IP有限责任公司 2021-06-08 — — CN 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-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 (15 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 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-11299492-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-11718616-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-11786517-B2 Methods of treatment using a JAK inhibitor compound JAK1, JAK2, JAK3 KDM1A 355/4885MAPK1 146/4885MAPT 3933/4885
US-20180311223-A1 CRYSTALLINE FORMS OF A JAK INHIBITOR COMPOUND JAK1, JAK2, JAK3 KDM1A 353/4885MAPK1 278/4885MAPT 1817/4885
US-20220306624-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-20210130351-A1 JAK KINASE INHIBITOR COMPOUNDS FOR TREATMENT OF RESPIRATORY DISEASE JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-20220008403-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND JAK1, JAK2, JAK3 KDM1A 355/4885MAPK1 146/4885MAPT 3933/4885
US-20180319796-A1 JAK Kinase Inhibitor Compounds for Treatment of Respiratory Disease JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-20170121327-A1 JAK Kinase Inhibitor Compounds for Treatment of Respiratory Disease JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-11160800-B2 Methods of treatment using a JAK inhibitor compound JAK1, JAK2, JAK3 KDM1A 355/4885MAPK1 146/4885MAPT 3933/4885
US-10183942-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885
US-20180311226-A1 METHODS OF TREATMENT USING A JAK INHIBITOR COMPOUND JAK1, JAK2, JAK3 KDM1A 355/4885MAPK1 146/4885MAPT 3933/4885
US-10251874-B2 Crystalline forms of a JAK inhibitor compound JAK1, JAK2, JAK3 KDM1A 353/4885MAPK1 278/4885MAPT 1817/4885
US-10100049-B2 JAK kinase inhibitor compounds for treatment of respiratory disease JAK1, JAK2, JAK3 KDM1A 473/4885MAPK1 57/4885MAPT 3850/4885

“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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