SCHEMBL9961397

SCHEMBL9961397

Cc1nc(-c2ccccc2)c(-c2ccncc2)n1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD3 Q9BZ95 1/20 0.55
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALOX5 P09917 1/20 0.48
MAPK14 Q16539 9/20 0.48
MAPK13 O15264 5/20 0.48
MAPK12 P53778 5/20 0.48
MAPK11 Q15759 5/20 0.48
GCGR P47871 2/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NOTUM Q6P988 1/20 0.45
CSNK1D P48730 2/20 0.44
PTGER1 P34995 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPK9 P45984 2/20 0.43
PRKD3 O94806 1/20 0.43

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
SCHEMBL11516631 0.91 KDM4E (0.51) NSD3MEN1KMT2AKDM4EALDH1A1
SCHEMBL7415940 0.81 ALDH1A1 (0.56) NSD3MEN1KMT2AALOX5MAPK14
SCHEMBL7237190 0.78 NSD3 (0.50) NSD3MEN1KMT2AMAPK14MAPK13
SCHEMBL7395143 0.78 NSD3 (0.50) NSD3MEN1KMT2AMAPK14MAPK13
SCHEMBL7236770 0.78 NSD3 (0.50) NSD3MEN1KMT2AALOX5MAPK14
SCHEMBL20271796 0.78 FABP4 (0.51) NSD3MEN1KMT2AALOX5MAPK14
SCHEMBL9961400 0.78 CSNK1D (0.43) NSD3ALOX5CSNK1DATM
SCHEMBL4429243 0.77 TEK (0.60) NSD3MEN1KMT2AALOX5MAPK14
SCHEMBL5082102 0.77 TEK (0.60) NSD3MEN1KMT2AALOX5MAPK14
SCHEMBL822678 0.77 PTGER1 (0.56) ALOX5MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536164-B2 Fused pyridine compounds as casein kinase inhibitors PFIZER INC. (US) 2013-09-17 US disclosed
US-20120157440-A1 NOVEL FUSED PYRIDINE COMPOUNDS AS CASEIN KINASE INHIBITORS PFIZER INC 2012-06-21 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 (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-20120157440-A1 NOVEL FUSED PYRIDINE COMPOUNDS AS CASEIN KINASE INHIBITORS CSNK1A1, CSNK1A1L, CSNK1E NSD3 1896/4885MEN1 4481/4885KMT2A 1752/4885

“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.