SCHEMBL9399475

SCHEMBL9399475

C=CCc1cc(S)cc(CC=C)c1N

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
POLB P06746 1/20 0.32

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
SCHEMBL1865361 0.81 GABRA1 (0.48) GABRA1GABRB2POLB
SCHEMBL2162708 0.79 XDH (0.39) GABRA1GABRB2POLB
SCHEMBL9399710 0.79 GABRA1 (0.38) GABRA1GABRB2POLB
SCHEMBL671144 0.77 PTGDR (0.40) GABRA1GABRB2POLB
SCHEMBL20681220 0.77 GABRA1 (0.36) GABRA1GABRB2POLB
SCHEMBL10410485 0.77 GABRA1 (0.36) GABRA1GABRB2POLB
SCHEMBL3407146 0.77 GABRA1 (0.45) GABRA1GABRB2POLB
SCHEMBL467130 0.77 DHFR (0.39) GABRA1GABRB2POLB
SCHEMBL9721939 0.77 GABRA1 (0.45) GABRA1GABRB2POLB
Bromide SCHEMBL10410488 0.76 GABRA1 (0.35) GABRA1GABRB2POLB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5321067-A Oxidation, heat resistance CIBA-GEIGY CORPORATION (US) 1994-06-14 US disclosed
US-5321067-A Oxidation, heat resistance CIBA-GEIGY CORPORATION (US) 1994-06-14 US disclosed
US-5321067-A Oxidation, heat resistance CIBA-GEIGY CORPORATION (US) 1994-06-14 US disclosed
US-5145970-A Oil additives CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed
US-5145970-A Oil additives CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed
US-5145970-A Oil additives CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed