SCHEMBL9566191

SCHEMBL9566191

CC(CCc1ccccc1Br)O[Si](C)(C)C(C)(C)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.37
IDO1 P14902 2/20 0.36
RIPK1 Q13546 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31

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
SCHEMBL9566318 0.80 TAAR1 (0.39) TAAR1IDO1RIPK1CTSSCTSK
SCHEMBL9009573 0.78 TAAR1 (0.37) TAAR1IDO1RIPK1CTSSCTSK
SCHEMBL9718099 0.71 TAAR1 (0.36) TAAR1IDO1RIPK1CTSSCTSK
SCHEMBL4365156 0.69 TAAR1 (0.54) TAAR1IDO1
SCHEMBL9565742 0.68 HTR1A (0.37)
SCHEMBL4769399 0.68 APLNR (0.38) TAAR1IDO1
SCHEMBL6347925 0.67 TAAR1 (0.43) TAAR1IDO1RIPK1
SCHEMBL30271106 0.67 TAAR1 (0.43) TAAR1IDO1RIPK1
SCHEMBL30521500 0.67 SLC6A2 (0.61) TAAR1IDO1
SCHEMBL623814 0.67 SLC6A2 (0.61) TAAR1IDO1

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-0536713-A1 Oxazole and imidazole derivatives as prostaglandin analogs E.R. SQUIBB & SONS, INC. (US) 1993-04-14 EP disclosed