SCHEMBL3370940

SCHEMBL3370940

CSc1cc(C(Br)Br)c(SC)cc1C

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 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
SCHEMBL3372808 0.78 ALDH1A1 (0.38) TAS1R3TAS1R1
SCHEMBL735440 0.73 CYP3A4 (0.36) TAS1R3TAS1R1
SCHEMBL24423318 0.71 TAS1R3 (0.34) TAS1R3TAS1R1
SCHEMBL18435416 0.70 RAB9A (0.39)
SCHEMBL19919532 0.67 CYP3A4 (0.33) TAS1R3TAS1R1
SCHEMBL2790439 0.67 LMNA (0.55)
SCHEMBL25302545 0.65 BCHE (0.30)
SCHEMBL17209118 0.65 ALDH1A1 (0.32)
SCHEMBL11449363 0.65 ALOX15 (0.50) TAS1R3TAS1R1
SCHEMBL14176621 0.63 KDM4E (0.40)

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
EP-2236488-A1 Materials, methods and uses for photochemical generation of acids and/or radical species The Arizona Board of Regents on behalf of the University of Arizona (US) 2010-10-06 EP disclosed