SCHEMBL9953786

SCHEMBL9953786

CC[S+]([O-])c1cccc(C(F)(F)F)c1-c1ncco1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.35
CFTR P13569 1/20 0.32
SCD O00767 1/20 0.32
CBLB Q13191 1/20 0.30

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
SCHEMBL9952746 0.74 GABRG2 (0.44) P2RX7CFTRSCDCBLB
SCHEMBL9953189 0.73 NR1H2 (0.41) P2RX7CFTRCBLB
SCHEMBL27317152 0.71 IDO1 (0.35)
SCHEMBL9953051 0.70 GRM2 (0.33)
SCHEMBL21848966 0.67 HCRTR1 (0.39) P2RX7
SCHEMBL21849756 0.66 HCRTR1 (0.36) P2RX7
SCHEMBL26028910 0.65 GABRA1 (0.41) P2RX7
SCHEMBL9952869 0.65 HTR2C (0.30)
SCHEMBL9953831 0.65 OPRK1 (0.34) SCDCBLB
SCHEMBL31348092 0.65 TRPV1 (0.40) CFTRSCD

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
EP-2655337-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF Sumitomo Chemical Company Limited (JP) 2013-10-30 EP disclosed
WO-2012086848-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-28 WO disclosed