SCHEMBL7920682

SCHEMBL7920682

Cc1ccc2c(c1)NC(C)N2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN7 P35236 1/20 0.37
▸ CYP1A2 P05177 3/20 0.36
▸ CYP2A6 P11509 2/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ CSNK1G1 Q9HCP0 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ ROS1 P08922 1/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ ACVR1 Q04771 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ CA12 O43570 1/20 0.32

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
SCHEMBL14044099 0.86 PTPN7 (0.37) PTPN7CYP1A2CYP2A6BRD4CREBBP
SCHEMBL6060242 0.79 PTPN7 (0.40) PTPN7CYP1A2CYP2A6BRD4CREBBP
SCHEMBL23787997 0.79 PTPN7 (0.36) PTPN7CYP1A2CYP2A6BRD4CREBBP
SCHEMBL25053007 0.74 KDM4E (0.53) CYP1A2ALDH1A1HSD17B10MAPTKDM4E
SCHEMBL13982019 0.74 KDM4E (0.53) CYP1A2ALDH1A1HSD17B10MAPTKDM4E
SCHEMBL23063003 0.74 BRD4 (0.42) CYP1A2BRD4ALDH1A1HSD17B10MAPT
SCHEMBL12403791 0.74 MEN1 (0.53) CYP1A2ALDH1A1MAPTKDM4EGAA
SCHEMBL16705496 0.73 KMT2A (0.49) CYP1A2CSNK1G1ALDH1A1HSD17B10KDM4E
SCHEMBL30570966 0.73 CYP1A2 (0.38) PTPN7CYP1A2BRD4CREBBPALDH1A1
SCHEMBL14105035 0.73 KMT2A (0.57) CYP1A2ALDH1A1HSD17B10MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019118785-A2 INHIBITORS OF INTEGRATED STRESS RESPONSE PATHWAY Praxis Biotech LLC (US) 2019-06-20 — — WO disclosed
EP-3438106-A1 ANTI-VIRAL COMPOUNDS AbbVie Ireland Unlimited Company (IE) 2019-02-06 — — EP disclosed
US-9315630-B2 Anion-conducting polymer SIMON FRASER UNIVERSITY (CA) 2016-04-19 — — US disclosed
US-20150073063-A1 ANION-CONDUCTING POLYMER SIMON FRASER UNIVERSITY (CA) 2015-03-12 — — US disclosed
EP-1643991-B1 BENZIMIDAZOLE CARBOXAMIDES AS RAF KINASE INHIBITORS MERCK PATENT GMBH (DE) 2014-03-12 — — EP disclosed
US-8501804-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-08-06 — — US disclosed
US-20120010247-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-12 — — US disclosed
EP-2351743-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-08-03 — — EP disclosed
WO-2010050445-A1 BICYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2010-05-06 — — WO disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 — — US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 — — 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 (1 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-20120010247-A1 BICYCLIC COMPOUND ACACA, CPT1B, ACACB PTPN7 2519/4885CYP1A2 2432/4885CYP2A6 3139/4885

“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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