SCHEMBL22336436

SCHEMBL22336436

C=C(C)C(=C)OC12CC3CC(C1)CC(C(=O)OC(CS(=O)(=O)O)(C(F)(F)F)C(F)(F)F)(C3)C2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 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
SCHEMBL20342010 0.92 NPSR1 (0.31) NPSR1
SCHEMBL26619873 0.83 NPSR1 (0.32) NPSR1
SCHEMBL18470420 0.83 NPSR1 (0.30) NPSR1
SCHEMBL22317808 0.82 — —
SCHEMBL23519202 0.81 NPSR1 (0.31) NPSR1
SCHEMBL26762277 0.81 — —
SCHEMBL20013713 0.81 NPSR1 (0.30) NPSR1
SCHEMBL18561114 0.81 NPSR1 (0.30) NPSR1
SCHEMBL20013493 0.79 ALDH1A1 (0.43) NPSR1
SCHEMBL18573180 0.79 — —

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
US-20200259094-A1 CONDUCTIVE POLYMER COMPOSITE AND CONDUCTIVE POLYMER COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-08-13 — — US disclosed
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