SCHEMBL546185

SCHEMBL546185

c1ccc(Oc2cccc3cccnc23)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.68
▸ MAPT P10636 3/20 0.68
▸ KDM4E B2RXH2 4/20 0.67
▸ LMNA P02545 6/20 0.55
▸ METAP2 P50579 2/20 0.55
▸ METAP1 P53582 2/20 0.55
▸ HDAC6 Q9UBN7 1/20 0.55
▸ HTT P42858 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ NPC1 O15118 3/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ HSP90AA1 P07900 1/20 0.51
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ MAPK1 P28482 1/20 0.49

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
Hydrochloric Acid SCHEMBL9052059 0.98 RAB9A (0.66) RAB9AMAPTKDM4ELMNAMETAP2
SCHEMBL4386263 0.86 KDM4E (0.72) RAB9AMAPTKDM4ELMNAMETAP2
SCHEMBL9447019 0.84 KDM4E (0.57) RAB9AMAPTKDM4ELMNAHTT
SCHEMBL8203474 0.84 KDM4E (0.57) RAB9AMAPTKDM4ELMNASMN1; SMN2
SCHEMBL6222129 0.84 KDM4E (0.57) RAB9AMAPTKDM4ELMNAHTT
SCHEMBL8043868 0.82 LMNA (0.57) RAB9AMAPTKDM4ELMNAMETAP2
SCHEMBL7208902 0.82 KDM4E (0.54) RAB9AMAPTKDM4ELMNAHTT
SCHEMBL7212405 0.82 KDM4E (0.54) RAB9AMAPTKDM4ELMNAHTT
SCHEMBL9446981 0.82 KDM4E (0.54) RAB9AMAPTKDM4ELMNAHTT
SCHEMBL6026678 0.81 RAB9A (0.69) RAB9AMAPTKDM4ELMNAMETAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153791-B2 substituted pyrimidine compoundssuch as 4-amino-6-(3-chloro-4-fluoro-phenylamino)-pyrimidine-5-carbaldehyde O-methyl oxime, used for treating, preventing or ameliorating a chronic or acute protein kinase mediated diseasea, disorders or conditions JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-10 — — US claimed
US-20070270425-A1 SUBSTITUTED PYRIMIDINYL OXIME KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-22 — — US claimed
EP-1075483-B1 HYGROMYCIN A DERIVATIVES PFIZER PROD INC (US) 2003-12-03 — — EP claimed
US-20030220365-A1 Cell adhesion-inhibiting antiinflammatory compounds STEWART ANDREW O (US) 2003-11-27 — — US claimed
EP-1077984-B1 2\"-DEOXY HYGROMYCIN DERIVATIVES PFIZER PROD INC (US) 2003-06-18 — — EP claimed
US-6342497-B1 2″-deoxy hygromycin derivatives PFIZER INC 2002-01-29 — — US claimed
US-6313100-B1 ANTIBACTERIAL, ANTIPROTOZOA AGENTS PFIZER INC 2001-11-06 — — US claimed
US-20010020030-A1 Cell adhesion-inhibiting antiinflammatory compounds ABBVIE INC. 2001-09-06 — — US claimed
EP-0445731-B1 Azabicyclo and azacyclo oxime and amine cholinergic agents and pharmaceutically acceptable salts thereof WARNER LAMBERT CO (US) 1996-01-10 — — EP claimed
US-5482938-A Azabicyclo and azacyclo oxime and amine cholinergic agents and methods of treatment WARNER-LAMBERT COMPANY (US) 1996-01-09 — — US claimed
EP-4392397-A2 PROCESS OF MAKING APOPTOSIS-INDUCING AGENTS AbbVie Inc. (US) 2024-07-03 — — EP disclosed
CN-118043320-A Polymorphs having pesticidal activity 科迪华农业科技有限责任公司 2024-05-14 — — CN disclosed
WO-2023028558-A2 PROCESS OF MAKING APOPTOSIS-INDUCING AGENTS ABBVIE INC. (US) 2023-03-02 — — WO disclosed
US-20230002389-A1 ADENINE ANALOGS, PRODRUGS, DERIVATIVES, COMPOSITIONS AND USES THEREOF PADIA JANAK KHIMCHAND (US) 2023-01-05 — — US disclosed
EP-3380469-B1 BICYCLIC BET BROMODOMAIN INHIBITORS AND USES THEREOF CONVERGENE LLC (US) 2022-03-16 — — EP disclosed
US-4728668-A Aryl and heteroaryl ethers as agents for the treatment of hypersensitive ailments USV PHARMACEUTICAL CORPORATION (US) 1988-03-01 — — US disclosed
US-4725619-A Aryl and heteroaryl ethers as agents for the treatment of hypersensitive ailments USV PHARMACEUTICAL CORPORATION (US) 1988-02-16 — — US disclosed
US-4631287-A Aryl and heteroaryl ethers as agents for the treatment of hypersensitive ailments USV PHARMACEUTICAL CORP. (US) 1986-12-23 — — US disclosed
EP-0200101-A2 Aryl and heteroaryl ethers as agents for the treatment of hypersensitive aliments USV PHARMACEUTICAL CORPORATION (US) 1986-11-05 — — EP disclosed
EP-0154142-A1 Substituted hexahydro arylquinolizines MERCK & CO. INC. (US) 1985-09-11 — — EP 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 (4 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-20010020030-A1 Cell adhesion-inhibiting antiinflammatory compounds ICAM1, VCAM1, EPCAM RAB9A 1542/4885MAPT 3906/4885KDM4E 4588/4885
US-20230002389-A1 ADENINE ANALOGS, PRODRUGS, DERIVATIVES, COMPOSITIONS AND USES THEREOF APRT, HPRT1, NUDT1 RAB9A 1168/4885MAPT 2688/4885KDM4E 1821/4885
US-20030220365-A1 Cell adhesion-inhibiting antiinflammatory compounds ICAM1, VCAM1, EPCAM RAB9A 1542/4885MAPT 3906/4885KDM4E 4588/4885
US-20070270425-A1 SUBSTITUTED PYRIMIDINYL OXIME KINASE INHIBITORS MAP3K2, MAP3K1, MAP3K20 RAB9A 3964/4885MAPT 3084/4885KDM4E 1680/4885

“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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