SCHEMBL692108

SCHEMBL692108

Clc1cccc(Oc2cc(Cl)ncn2)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
MAP4K4 O95819 1/20 0.52
GRM5 P41594 3/20 0.46
EGFR P00533 3/20 0.46
LCK P06239 1/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KMO O15229 1/20 0.43
HRH3 Q9Y5N1 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
TTBK1 Q5TCY1 1/20 0.41
DCK P27707 1/20 0.41
MAP2K7 O14733 1/20 0.40
MAPK10 P53779 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
SCHEMBL191210 0.84 NPC1 (0.61) CYP1A2CYP2C9CYP2C19MAP4K4NPC1
SCHEMBL31384071 0.83 MAOB (0.49) CYP1A2CYP2C9CYP2C19MAP4K4EGFR
SCHEMBL12825410 0.83 EGFR (0.53) CYP1A2CYP2C9CYP2C19MAP4K4GRM5
SCHEMBL691398 0.81 NPC1 (0.57) CYP1A2CYP2C9CYP2C19MAP4K4NPC1
SCHEMBL1414937 0.80 MEN1 (0.54) CYP1A2CYP2C9CYP2C19NPC1RAB9A
SCHEMBL7783065 0.80 ALDH1A1 (0.54) RAB9AL3MBTL1MAP2K7
SCHEMBL3410505 0.79 MEN1 (0.53) CYP1A2CYP2C9CYP2C19NPC1RAB9A
SCHEMBL959384 0.79 L3MBTL1 (0.57) CYP1A2CYP2C9CYP2C19MAP4K4GRM5
SCHEMBL8773803 0.79 ALDH1A1 (0.53) RAB9AL3MBTL1MAP2K7
SCHEMBL7790214 0.78 HAO1 (0.47) CYP1A2CYP2C9CYP2C19NPC1RAB9A

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4725942-A1 COMPOUNDS ACTIVE ON CYCLIN D1 PATHWAY AND THEIR USE Sibylla Biotech S.p.A. (IT) 2026-04-15 EP disclosed
US-20160279127-A1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. 2016-09-29 US disclosed
US-9296704-B2 Substituted pyrimidines as protein kinase inhibitors CELGENE AVILOMICS RESEARCH, INC. (US) 2016-03-29 US disclosed
WO-2015057963-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed
US-20140303165-A1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. 2014-10-09 US disclosed
US-8748606-B2 4,6-diaminopyrimidines useful as kinase inhibitors CELGENE AVILOMICS RESEARCH, INC. (US) 2014-06-10 US disclosed
US-20130065892-A1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2013-03-14 US disclosed
US-8329901-B2 4,6-disubstitued pyrimidines useful as kinase inhibitors CELGENE AVILOMICS RESEARCH, INC. (US) 2012-12-11 US disclosed
CN-102448462-A Heteroaryl compounds and uses thereof AVILA THERAPEUTICS INC 2012-05-09 CN disclosed
EP-2421538-A1 HETEROARYL COMPOUNDS AND USES THEREOF Avila Therapeutics, Inc. (US) 2012-02-29 EP disclosed
US-20110224432-A1 HETEROARYL COMPOUNDS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2011-09-15 US disclosed
US-7989465-B2 4,6-disubstituted pyrimidines useful as kinase inhibitors AVILA THERAPEUTICS, INC. (US) 2011-08-02 US disclosed
WO-2010123870-A1 HETEROARYL COMPOUNDS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2010-10-28 WO disclosed
US-20100016296-A1 HETEROARYL COMPOUNDS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2010-01-21 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 (5 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-20130065892-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 CYP1A2 20/4885CYP2C9 4/4885CYP2C19 11/4885
US-20160279127-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 CYP1A2 20/4885CYP2C9 4/4885CYP2C19 11/4885
US-20100016296-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 CYP1A2 20/4885CYP2C9 4/4885CYP2C19 11/4885
US-20110224432-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 CYP1A2 20/4885CYP2C9 4/4885CYP2C19 11/4885
US-20140303165-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 CYP1A2 20/4885CYP2C9 4/4885CYP2C19 11/4885

“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.