SCHEMBL9952641

SCHEMBL9952641

CCS(=O)(=O)c1cccc(OC(F)(F)F)c1-c1nccn1C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.38
KDM2B Q8NHM5 1/20 0.37
HTR6 P50406 1/20 0.35
RORC P51449 5/20 0.35
SSTR4 P31391 8/20 0.35
SSTR1 P30872 6/20 0.35
ALPL P05186 1/20 0.34
BRD4 O60885 1/20 0.34
FFAR1 O14842 1/20 0.34

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
SCHEMBL9953076 0.80 KDM4E (0.33) BRD4
SCHEMBL9952655 0.78 CNR2 (0.32) BRD4
SCHEMBL9952073 0.78 KDM4E (0.35) SSTR4BRD4
SCHEMBL9953584 0.74 BRD4 (0.40) BRD4FFAR1
SCHEMBL21216562 0.73 HTR6 (0.48) SLC40A1KDM2BHTR6RORCALPL
SCHEMBL9953805 0.72 BRD4 (0.49) BRD4
SCHEMBL9953091 0.69 NFE2L2 (0.36) HTR6
SCHEMBL18989038 0.68 MCL1 (0.44)
SCHEMBL29755370 0.68 MCL1 (0.44)
SCHEMBL9953345 0.67 MCL1 (0.34)

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