SCHEMBL9952869

SCHEMBL9952869

CC[S+]([O-])c1cccc(C(F)(F)C(F)(F)F)c1-c1nccn1C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 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
SCHEMBL9951940 0.94
SCHEMBL9953831 0.81 OPRK1 (0.34) HTR2C
SCHEMBL9953547 0.81 BRD4 (0.34) HTR2C
SCHEMBL9953170 0.76 SCN9A (0.32) HTR2C
SCHEMBL9952781 0.75 OPRK1 (0.32)
SCHEMBL9952037 0.75 OPRK1 (0.32)
SCHEMBL9952128 0.75 HSD11B1 (0.32)
SCHEMBL9953051 0.74 GRM2 (0.33) HTR2C
SCHEMBL9952655 0.68 CNR2 (0.32)
SCHEMBL3727620 0.67 BRD4 (0.33)

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