SCHEMBL3265259

SCHEMBL3265259

CC(CNC(=O)c1cc(F)cc([As](C2CN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)C2)S(C)(=O)=O)c1)c1cnccn1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.36
CTSS P25774 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 2/20 0.34
CXCR3 P49682 1/20 0.33
CYP3A4 P08684 2/20 0.33
CYP3A5 P20815 2/20 0.33
LMNA P02545 3/20 0.32
TSHR P16473 1/20 0.32
P2RX7 Q99572 2/20 0.32
SCN9A Q15858 1/20 0.32
EPHX2 P34913 1/20 0.32

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
SCHEMBL1995651 0.83 F2 (0.36) IDO1CTSSSMN1; SMN2NPSR1HTT
SCHEMBL1995652 0.82 SCN9A (0.35) IDO1SMN1; SMN2NPSR1HTTTP53
SCHEMBL1551683 0.72 CYP3A4 (0.42) SMN1; SMN2NPSR1HTTTP53CYP3A4
SCHEMBL1991847 0.71 SMN1; SMN2 (0.40) SMN1; SMN2NPSR1HTTTP53CYP3A4
SCHEMBL3401787 0.67 F2 (0.39) IDO1SMN1; SMN2TP53LMNAP2RX7
SCHEMBL1990364 0.67 F2 (0.38) IDO1SMN1; SMN2TP53LMNAP2RX7
SCHEMBL1551280 0.67 LMNA (0.46) SMN1; SMN2NPSR1HTTLMNATSHR
SCHEMBL1551573 0.66 SMN1; SMN2 (0.43) SMN1; SMN2HTTCYP3A4LMNA
SCHEMBL1551297 0.66 CYP19A1 (0.38) IDO1TP53P2RX7
SCHEMBL1551019 0.65 F2 (0.36) IDO1TP53P2RX7

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-2010018328-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2010-02-18 WO claimed