SCHEMBL16094728

SCHEMBL16094728

Fc1ccc(-c2[nH]c(CCc3ccccc3Cl)nc2-c2cc(-c3nn[nH]n3)ccn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 18/20 0.64
▸ KDM2B Q8NHM5 1/20 0.54
▸ KDM5A P29375 3/20 0.53
▸ KDM5B Q9UGL1 1/20 0.53
▸ MAPK14 Q16539 2/20 0.44
▸ MAPK13 O15264 1/20 0.44
▸ GCGR P47871 1/20 0.44
▸ MAPK12 P53778 1/20 0.44
▸ MAPK11 Q15759 1/20 0.44
▸ GSK3B P49841 1/20 0.42

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
SCHEMBL16094861 0.93 KDM4C (0.62) KDM4CKDM2BKDM5AKDM5BMAPK14
SCHEMBL16095092 0.93 KDM4C (0.63) KDM4CKDM2BKDM5AKDM5B
SCHEMBL16103402 0.81 KDM4C (0.59) KDM4CKDM2BKDM5AKDM5B
SCHEMBL16094879 0.81 KDM4C (0.61) KDM4CKDM5AKDM5BMAPK14MAPK13
SCHEMBL16096065 0.80 KDM4C (0.60) KDM4CKDM2BKDM5AKDM5BMAPK14
SCHEMBL16095105 0.80 MAPK14 (0.46) KDM4CMAPK14MAPK13GCGRMAPK12
SCHEMBL16033547 0.78 KDM4C (1.00) KDM4CKDM2BKDM5AKDM5B
SCHEMBL16033821 0.77 KDM4C (1.00) KDM4CKDM2BKDM5AKDM5B
SCHEMBL16095315 0.74 KDM4C (0.60) KDM4CKDM2BKDM5AKDM5B
SCHEMBL16095914 0.72 MAPK14 (0.50) KDM4CMAPK14MAPK13GCGRMAPK12

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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