SCHEMBL19085000

SCHEMBL19085000

O=C(O)c1ccnc(-c2c[nH]cn2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 8/20 0.58
KDM5C P41229 7/20 0.58
KDM4A O75164 6/20 0.58
KDM2A Q9Y2K7 5/20 0.58
KDM3A Q9Y4C1 5/20 0.58
KDM4E B2RXH2 5/20 0.58
KDM6B O15054 4/20 0.58
P4HA1 P13674 1/20 0.57
JMJD6 Q6NYC1 1/20 0.56
KDM5B Q9UGL1 6/20 0.54
KDM4B O94953 3/20 0.54
KDM5A P29375 3/20 0.50
KMO O15229 1/20 0.49
TET3 O43151 1/20 0.49
BBOX1 O75936 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
ASPH Q12797 1/20 0.49
KDM4D Q6B0I6 1/20 0.49
TET2 Q6N021 1/20 0.49

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
SCHEMBL4921443 0.86 KDM4C (0.75) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL16033613 0.85 KDM5C (0.54) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL70700 0.84 KDM4C (0.78) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL29407015 0.84 KDM4C (0.78) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL25273097 0.82 KDM4C (0.75) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL5670010 0.82 KDM4C (0.75) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL7034221 0.82 KDM4C (0.75) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL25221788 0.82 KDM4C (0.75) KDM4CKDM5CKDM4AKDM2AKDM3A
Hydrochloric Acid SCHEMBL6018233 0.82 KDM4C (0.75) KDM4CKDM5CKDM4AKDM2AKDM3A
SCHEMBL9626459 0.82 KDM4C (0.75) KDM4CKDM5CKDM4AKDM2AKDM3A

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
US-9701657-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-07-11 US disclosed