SCHEMBL14186232

SCHEMBL14186232

Cc1ccc(C2CCN(C)CC2)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 2/20 0.46
DRD2 P14416 1/20 0.46
OPRM1 P35372 1/20 0.44
OPRL1 P41146 1/20 0.44
CXCR4 P61073 1/20 0.43
CCR1 P32246 1/20 0.43
CCR5 P51681 1/20 0.43
CCR8 P51685 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
WNT3A P56704 1/20 0.42
KDM5A P29375 1/20 0.41
PDE10A Q9Y233 1/20 0.41
MAP4K4 O95819 1/20 0.41
LRRK2 Q5S007 1/20 0.40
SYK P43405 1/20 0.40
MAPK11 Q15759 1/20 0.39
MAPK14 Q16539 1/20 0.39
QDPR P09417 1/20 0.39
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38

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
SCHEMBL827646 0.86 CCR1 (0.52) DRD4DRD2OPRM1OPRL1CCR1
Ammonia Solution, Strong SCHEMBL17820158 0.84 CCR1 (0.50) DRD4DRD2OPRM1OPRL1CCR1
SCHEMBL24681892 0.84 DRD4 (0.45) DRD4DRD2OPRM1OPRL1CXCR4
SCHEMBL27543939 0.84 DRD4 (0.45) DRD4DRD2OPRM1OPRL1CXCR4
SCHEMBL23331881 0.82 CCR1 (0.48) DRD4DRD2OPRM1OPRL1CCR1
SCHEMBL12093753 0.82 CCR1 (0.48) DRD4DRD2OPRM1OPRL1CXCR4
SCHEMBL13724434 0.82 KDM5A (0.44) WNT3AKDM5AMAP4K4LRRK2SYK
SCHEMBL21037741 0.82 DRD4 (0.48) DRD4DRD2WNT3ASYKMAPK11
SCHEMBL21038285 0.82 OPRM1 (0.42) OPRM1OPRL1WNT3AMAPK11MAPK14
SCHEMBL29601235 0.82 OPRM1 (0.42) DRD4DRD2OPRM1OPRL1WNT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3750880-B1 PYRAZINE-2(1H)-KETONE COMPOUND ACTING AS FGFR INHIBITOR ZHANGZHOU PIEN TZE HUANG PHARM (CN) 2022-12-21 EP disclosed
WO-2022236256-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO INC. (US) 2022-11-10 WO disclosed
US-11286248-B2 Pyrazine-2(1H)-ketone compound acting as FGFR inhibitor ZHANGZHOU PIEN TZE HUANG PHARMACEUTICAL CO., LTD. (CN) 2022-03-29 US disclosed
US-20210040070-A1 PYRAZINE-2(1H)-KETONE COMPOUND ACTING AS FGFR INHIBITOR ZHANGZHOU PIEN TZE HUANG PHARMACEUTICAL CO., LTD. (CN) 2021-02-11 US disclosed
EP-3750880-A1 PYRAZINE-2(1H)-KETONE COMPOUND ACTING AS FGFR INHIBITOR Zhangzhou Pien Tze Huang Pharmaceutical Co., Ltd (CN) 2020-12-16 EP disclosed
WO-2019154364-A1 PYRAZINE-2(1H)-KETONE COMPOUND ACTING AS FGFR INHIBITOR 南京明德新药研发有限公司 2019-08-15 WO disclosed
US-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-08-10 US disclosed
US-20160185780-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-06-30 US disclosed
US-20080119515-A1 Heterocyclic Kinase Inhibitors: Methods of Use and Synthesis SCHERING CORPORATION 2008-05-22 US disclosed
US-20080119515-A1 Heterocyclic Kinase Inhibitors: Methods of Use and Synthesis SCHERING CORPORATION 2008-05-22 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-20160185780-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 DRD4 4544/4885DRD2 4124/4885OPRM1 1787/4885
US-20210040070-A1 PYRAZINE-2(1H)-KETONE COMPOUND ACTING AS FGFR INHIBITOR FGFR1, FGFR2, FGFR3 DRD4 4879/4885DRD2 4794/4885OPRM1 4314/4885
US-20080119515-A1 Heterocyclic Kinase Inhibitors: Methods of Use and Synthesis MAP3K20, MAP3K1, MAP3K19 DRD4 4830/4885DRD2 4710/4885OPRM1 4221/4885
US-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 DRD4 4544/4885DRD2 4124/4885OPRM1 1787/4885
US-11286248-B2 Pyrazine-2(1H)-ketone compound acting as FGFR inhibitor FGFR1, FGFR2, FGFR3 DRD4 4879/4885DRD2 4794/4885OPRM1 4314/4885

“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.