SCHEMBL4064114

SCHEMBL4064114

C=C(OC(=O)Nc1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.54
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
RAB9A P51151 1/20 0.49
DEGS1 O15121 1/20 0.47
POLB P06746 1/20 0.46
STAT3 P40763 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PTPN11 Q06124 1/20 0.46
TRPV1 Q8NER1 1/20 0.44

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
SCHEMBL2244779 0.76 SMN1; SMN2 (0.61) MEN1KMT2ANPC1ALDH1A1RAB9A
SCHEMBL4056676 0.76 KDM4E (0.49) PTPN1MEN1KMT2ANPC1RAB9A
SCHEMBL12606901 0.74 NAPRT (0.55) KMT2ANPC1ALDH1A1RAB9APOLB
SCHEMBL2092940 0.74 PTPN1 (0.58) PTPN1MEN1KMT2ANPC1ALDH1A1
SCHEMBL2026664 0.73 PTPN1 (0.96) PTPN1MEN1KMT2ANPC1ALDH1A1
SCHEMBL4060036 0.72 ALDH1A1 (0.47) MEN1KMT2ANPC1ALDH1A1RAB9A
SCHEMBL2092941 0.72 SMN1; SMN2 (0.68) PTPN1MEN1KMT2ANPC1ALDH1A1
SCHEMBL27587344 0.72 KMT2A (0.53) PTPN1MEN1KMT2ANPC1ALDH1A1
SCHEMBL30549187 0.71 PTPN1 (1.00) PTPN1MEN1KMT2ANPC1ALDH1A1
SCHEMBL4311261 0.71 HTR1A (0.61) PTPN1MEN1KMT2AALDH1A1POLB

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-2009109504-A1 ENOL CARBAMATE DERIVATIVES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2009-09-11 WO disclosed