SCHEMBL16095914

SCHEMBL16095914

N#Cc1ccnc(-c2nc(Cc3ccccc3Cl)[nH]c2-c2ccc(F)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 10/20 0.50
▸ GSK3B P49841 2/20 0.41
▸ GSK3A P49840 1/20 0.41
▸ KDM4C Q9H3R0 5/20 0.39
▸ MAPK13 O15264 3/20 0.39
▸ MAPK12 P53778 3/20 0.39
▸ MAPK11 Q15759 3/20 0.39
▸ GCGR P47871 2/20 0.39
▸ ALOX5 P09917 2/20 0.39
▸ PPARG P37231 1/20 0.38
▸ TGFBR1 P36897 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ NPY5R Q15761 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL16095105 0.92 MAPK14 (0.46) MAPK14GSK3BGSK3AKDM4CMAPK13
SCHEMBL16095177 0.84 KDM4C (0.39) MAPK14GSK3BKDM4CMAPK13MAPK12
SCHEMBL16095603 0.82 LMNA (0.38) MAPK14KDM4CTGFBR1MAPT
SCHEMBL16095224 0.80 MAPK14 (0.48) MAPK14GSK3BGSK3AMAPK13MAPK12
SCHEMBL16094861 0.80 KDM4C (0.62) MAPK14GSK3BGSK3AKDM4C
SCHEMBL16094741 0.78 MAPK14 (0.48) MAPK14GSK3BGSK3AMAPK13MAPK12
SCHEMBL17604614 0.76 MAPK14 (0.46) MAPK14GSK3BMAPK13MAPK12MAPK11
SCHEMBL16095836 0.75 PHF8 (0.39) MAPK14KDM4CMAPT
SCHEMBL16094879 0.74 KDM4C (0.61) MAPK14GSK3BGSK3AKDM4CMAPK13
SCHEMBL16095079 0.74 ADORA2A (0.39) KDM4CNPY5RMAPT

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
EP-2969007-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 — — EP disclosed
WO-2014151945-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — WO disclosed
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