SCHEMBL19615441

SCHEMBL19615441

O=C(O)c1ccnc(/C(COc2cccc(OCc3ccccc3)c2)=N/O)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 7/20 0.57
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
FFAR1 O14842 1/20 0.50
MRGPRX4 Q96LA9 4/20 0.49
SRD5A2 P31213 1/20 0.49
NR1H4 Q96RI1 1/20 0.47
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PLA2G4B P0C869 1/20 0.46
MAOB P27338 1/20 0.46
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
SCHEMBL19615641 0.93 PLA2G4B (0.54) NR4A2MEN1KMT2AMRGPRX4SRD5A2
SCHEMBL19615520 0.92 NR4A2 (0.61) NR4A2KMT2AMRGPRX4TSHRSMN1; SMN2
SCHEMBL19615694 0.89 NR4A2 (0.57) NR4A2MEN1KMT2AFFAR1MRGPRX4
SCHEMBL19615654 0.89 AKR1C3 (0.49) NR4A2SMN1; SMN2
SCHEMBL19631994 0.88 KDM6B (0.51) NR4A2PLA2G4B
SCHEMBL19615487 0.86 MRGPRX4 (0.51) NR4A2MRGPRX4NR1H4
SCHEMBL19615728 0.86 LMNA (0.52) MEN1KMT2AMRGPRX4SMN1; SMN2
SCHEMBL19615691 0.85 KDM5A (0.48) NR4A2MEN1KMT2AFFAR1PLA2G4B
SCHEMBL19632190 0.84 NR4A2 (0.48) NR4A2MEN1KMT2AMRGPRX4SMN1; SMN2
SCHEMBL19616024 0.84 NR4A2 (0.51) NR4A2MRGPRX4NR4A1NR4A3

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 3 patents. 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 claimed
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
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