SCHEMBL20979030

SCHEMBL20979030

NN/N=C(\N)c1ccnc(-c2ncn(CC3CC3)c2-c2ccc(Cl)cc2)c1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 14/20 0.70
▸ KDM5A P29375 2/20 0.44
▸ KDM5B Q9UGL1 2/20 0.44
▸ MAPK14 Q16539 3/20 0.41
▸ MAPK13 O15264 2/20 0.41
▸ MAPK12 P53778 2/20 0.41
▸ MAPK11 Q15759 2/20 0.41
▸ KDM2B Q8NHM5 4/20 0.41
▸ MDM2 Q00987 2/20 0.38
▸ TGFBR1 P36897 1/20 0.38
▸ TP53 P04637 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
SCHEMBL20978863 0.91 KDM4C (0.70) KDM4CKDM5AKDM5BMAPK14MAPK13
SCHEMBL16033766 0.82 KDM4C (1.00) KDM4CKDM5AKDM5BKDM2B
SCHEMBL20978913 0.81 KDM4C (0.62) KDM4CKDM5AKDM5BKDM2B
SCHEMBL20979032 0.76 KDM4C (0.57) KDM4CKDM5AKDM5BMAPK14KDM2B
SCHEMBL16033590 0.75 KDM4C (0.67) KDM4CKDM5AKDM5BMAPK14MAPK13
SCHEMBL20978965 0.75 KDM4C (0.72) KDM4CKDM5AKDM5BMAPK14KDM2B
SCHEMBL20979070 0.74 KDM4C (0.72) KDM4CKDM5AKDM5BMAPK14KDM2B
SCHEMBL16033938 0.74 KDM4C (1.00) KDM4CKDM5AMAPK14MAPK13MAPK12
SCHEMBL2614578 0.73 MAPK14 (0.65) KDM4CMAPK14MAPK13MAPK12MAPK11
SCHEMBL16034499 0.73 KDM4C (1.00) KDM4CKDM5AKDM5BMAPK14MAPK13

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
EP-2969007-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2019-05-08 — — EP disclosed
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