SCHEMBL19631966

SCHEMBL19631966

O=C(O)c1ccnc(C(=O)Cc2ccc(OCc3ccccc3)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.57
NR4A1 P22736 1/20 0.57
NR4A3 Q92570 1/20 0.57
SRD5A2 P31213 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
PLA2G4B P0C869 1/20 0.51
ALOX5 P09917 2/20 0.50
NR1H4 Q96RI1 1/20 0.49
MRGPRX4 Q96LA9 5/20 0.49
TP53 P04637 2/20 0.49
PKM P14618 2/20 0.49
NFKB1 P19838 2/20 0.49
NFKB2 Q00653 2/20 0.49
RELA Q04206 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
RAB9A P51151 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
P4HTM Q9NXG6 1/20 0.49
KDM5A P29375 1/20 0.48

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
SCHEMBL19615912 0.88 KDM4C (0.61) SRD5A2RAB9AKDM5AKDM4CKDM5B
SCHEMBL19631956 0.88 NR4A2 (0.55) NR4A2NR4A1NR4A3SRD5A2MEN1
SCHEMBL19615897 0.86 ALOX5 (0.50) MEN1KMT2AALOX5NR1H4SMN1; SMN2
SCHEMBL19615650 0.86 NR4A2 (0.52) NR4A2NR4A1NR4A3SRD5A2MEN1
SCHEMBL6176980 0.83 ALOX5 (0.56) NR4A2NR4A1NR4A3SRD5A2ALOX5
SCHEMBL19615641 0.80 PLA2G4B (0.54) NR4A2NR4A1NR4A3SRD5A2MEN1
SCHEMBL389730 0.77 MEN1 (0.67) NR4A2NR4A1NR4A3SRD5A2MEN1
SCHEMBL19616535 0.77 NR4A2 (0.56) NR4A2KDM5AKDM4CKDM5BMAOB
SCHEMBL4220632 0.76 NR4A1 (0.72) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL19615722 0.76 MMP13 (0.50) NR4A2KDM5AKDM5BMAOBPARP10

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-2017198785-A1 OXIME DERIVATIVES USEFUL AS INHIBITORS OF HISTONE DEMETHYLASE KDM4C IEO - ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2017-11-23 WO disclosed