SCHEMBL20978863

SCHEMBL20978863

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

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 13/20 0.70
▸ MAPK14 Q16539 4/20 0.53
▸ MAPK13 O15264 2/20 0.53
▸ MAPK12 P53778 2/20 0.53
▸ MAPK11 Q15759 2/20 0.53
▸ KDM5A P29375 3/20 0.44
▸ KDM5B Q9UGL1 2/20 0.44
▸ KDM4A O75164 1/20 0.44
▸ TGFBR1 P36897 2/20 0.42
▸ TGFBR2 P37173 1/20 0.42
▸ KDM2B Q8NHM5 1/20 0.41
▸ CSNK1D P48730 1/20 0.39
▸ CSNK1E P49674 1/20 0.39

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
SCHEMBL20979030 0.91 KDM4C (0.70) KDM4CMAPK14MAPK13MAPK12MAPK11
SCHEMBL20979032 0.85 KDM4C (0.57) KDM4CMAPK14KDM5AKDM5BKDM4A
SCHEMBL16034499 0.82 KDM4C (1.00) KDM4CMAPK14MAPK13MAPK12MAPK11
SCHEMBL20978965 0.80 KDM4C (0.72) KDM4CMAPK14KDM5AKDM5BKDM4A
SCHEMBL20979070 0.80 KDM4C (0.72) KDM4CMAPK14KDM5AKDM5BKDM4A
SCHEMBL20978851 0.76 KDM4C (0.73) KDM4CKDM5AKDM5BKDM4AKDM2B
SCHEMBL16033165 0.75 KDM4C (0.67) KDM4CMAPK14MAPK13MAPK12MAPK11
SCHEMBL16032983 0.74 KDM4C (1.00) KDM4CMAPK14MAPK13MAPK12MAPK11
SCHEMBL30023277 0.73 MAPK14 (0.87) KDM4CMAPK14MAPK13MAPK12MAPK11
SCHEMBL20978917 0.73 KDM4C (0.67) KDM4CMAPK14KDM5AKDM2B

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
Send feedback