SCHEMBL8941244

SCHEMBL8941244

O=C(Nc1ccc(Cl)cc1)C(=O)Nc1cccnc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.82
KMT2A Q03164 5/20 0.82
RAB9A P51151 3/20 0.82
NAMPT P43490 3/20 0.75
NPC1 O15118 2/20 0.75
PKM P14618 1/20 0.75
CYP11B2 P19099 3/20 0.69
CYP11B1 P15538 1/20 0.69
LMNA P02545 3/20 0.60
MAPT P10636 3/20 0.60
ALDH1A1 P00352 2/20 0.60
CNR1 P21554 1/20 0.59
FFAR2 O15552 1/20 0.58
KDM4E B2RXH2 1/20 0.58
MAPK1 P28482 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
KCNMA1 Q12791 1/20 0.57
TP53 P04637 1/20 0.57
HTT P42858 1/20 0.57
CYP1A2 P05177 1/20 0.57

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
SCHEMBL9190814 0.90 KMT2A (1.00) MEN1KMT2ARAB9ANAMPTNPC1
SCHEMBL30504811 0.88 RAB9A (0.89) MEN1KMT2ARAB9ANAMPTNPC1
SCHEMBL10978857 0.82 CYP11B1 (1.00) MEN1KMT2ARAB9ANAMPTNPC1
SCHEMBL21568080 0.80 NPC1 (0.67) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL6630167 0.79 RAB9A (0.79) MEN1KMT2ARAB9ANAMPTNPC1
SCHEMBL11090153 0.79 NAMPT (0.78) MEN1KMT2ARAB9ANAMPTNPC1
SCHEMBL27308657 0.78 MEN1 (0.75) MEN1KMT2ARAB9ANAMPTCYP11B2
SCHEMBL6989004 0.77 RAB9A (0.71) MEN1KMT2ARAB9ANAMPTNPC1
SCHEMBL9262080 0.77 RAB9A (0.71) MEN1KMT2ARAB9ANAMPTNPC1
SCHEMBL10397597 0.77 RAB9A (0.65) MEN1KMT2ARAB9ANAMPTNPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8176110-A None JP disclosed
JP-H08176110-A N,N'-DI-SUBSTITUTED OXAMIDE DERIVATIVE AND PRODUCTION OF N,N'-DI-SUBSTITUTED ETHYLENEDIAMINE DERIVATIVE USING THE SAME KYORIN PHARMACEUT CO LTD 1996-07-09 JP disclosed