SCHEMBL16095409

SCHEMBL16095409

c1ccc2c(CCc3nc(-c4cc(-c5nn[nH]n5)ccn4)c[nH]3)cccc2c1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 16/20 0.65
▸ KDM5A P29375 6/20 0.49
▸ KDM5B Q9UGL1 2/20 0.49
▸ PHF8 Q9UPP1 3/20 0.48
▸ KDM2B Q8NHM5 2/20 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
SCHEMBL16095348 0.91 KDM4C (0.63) KDM4CKDM5AKDM5BPHF8KDM2B
SCHEMBL16095032 0.85 KDM4C (0.65) KDM4CKDM5AKDM5BPHF8KDM2B
SCHEMBL16095232 0.82 KDM4C (0.48) KDM4CKDM5AKDM5BKDM2B
SCHEMBL16095912 0.80 KDM4C (0.61) KDM4CKDM5AKDM5BPHF8KDM2B
SCHEMBL16034307 0.79 KDM4C (1.00) KDM4CKDM5AKDM5BPHF8KDM2B
SCHEMBL16095163 0.79 KDM4C (0.62) KDM4CKDM5AKDM5BPHF8KDM2B
SCHEMBL16094800 0.78 KDM4C (0.61) KDM4CKDM5AKDM5BPHF8
SCHEMBL17604567 0.77 PHF8 (0.42) KDM4CPHF8KDM2B
SCHEMBL16094923 0.77 PHF8 (0.43) KDM4CPHF8KDM2B
SCHEMBL16033793 0.76 KDM4C (1.00) KDM4CKDM5AKDM5BPHF8KDM2B

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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