SCHEMBL17621679

SCHEMBL17621679

C=C(N)c1ccnc(-c2cn(CCc3ccccc3OCC)cn2)c1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PHF8 Q9UPP1 7/20 0.63
▸ KDM4C Q9H3R0 9/20 0.63
▸ KDM4A O75164 4/20 0.63
▸ KDM2B Q8NHM5 2/20 0.56
▸ KDM5A P29375 7/20 0.55
▸ KDM5B Q9UGL1 7/20 0.55

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
SCHEMBL16034010 0.90 KDM4C (0.68) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL20978964 0.85 PHF8 (0.58) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL19383516 0.82 KDM2B (0.55) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL16034376 0.79 PHF8 (0.62) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL16035020 0.77 KDM4C (1.00) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL16034818 0.77 KDM4C (1.00) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL29376754 0.76 KDM4C (0.73) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL17604514 0.76 KDM4C (0.73) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL17693182 0.74 KDM4C (0.70) PHF8KDM4CKDM4AKDM2BKDM5A
SCHEMBL17898969 0.73 KDM4C (0.69) PHF8KDM4CKDM4AKDM2BKDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016044342-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2016-03-24 — — WO disclosed
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