SCHEMBL19632270

SCHEMBL19632270

O=C(O)c1ccnc(/C(=N/O)c2ccc(OCc3ccc(F)cc3)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 5/20 0.61
KDM5A P29375 5/20 0.50
KDM4C Q9H3R0 5/20 0.50
KDM5B Q9UGL1 5/20 0.50
PPARA Q07869 4/20 0.50
MAOB P27338 2/20 0.50
KDM2B Q8NHM5 1/20 0.50
PARP10 Q53GL7 1/20 0.50
RXRA P19793 3/20 0.45
RXRB P28702 3/20 0.45
NPC1 O15118 1/20 0.45
POLB P06746 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NR4A1 P22736 1/20 0.45
NR4A3 Q92570 1/20 0.45

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
SCHEMBL19615658 0.87 KDM5B (0.56) NR4A2KDM5AKDM4CKDM5BKDM2B
SCHEMBL19615548 0.86 NR4A2 (0.56) NR4A2KDM5AKDM4CKDM5BPPARA
SCHEMBL19616535 0.86 NR4A2 (0.56) NR4A2KDM5AKDM4CKDM5BPPARA
SCHEMBL19632107 0.80 NR4A2 (0.47) NR4A2KDM5AKDM4CKDM5BPPARA
SCHEMBL19615520 0.79 NR4A2 (0.61) NR4A2KDM5AKDM4CKDM5BPPARA
SCHEMBL19631979 0.78 KDM4E (0.51) KDM5AKDM4CKDM5BKDM2BNPC1
SCHEMBL19615732 0.78 KDM4E (0.51) KDM5AKDM4CKDM5BKDM2BNPC1
SCHEMBL19615660 0.78 NR4A2 (0.60) NR4A2KDM5AKDM4CKDM5BPPARA
SCHEMBL19631870 0.78 KDM4C (0.48) NR4A2KDM5AKDM4CKDM5BPPARA
SCHEMBL6412631 0.78 NR4A2 (1.00) NR4A2PPARAMAOBPARP10RXRA

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