SCHEMBL10188282

SCHEMBL10188282

O=C1C2CC3CC1CC(OCC(F)(F)SO)(C3)C2

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
EPHX2 P34913 2/20 0.36

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
SCHEMBL4326603 0.83 TSHR (0.47) TSHRNPSR1EPHX2
SCHEMBL26064079 0.79 TSHR (0.44) TSHRNPSR1EPHX2
SCHEMBL13005842 0.74 NPSR1 (0.49) TSHRNPSR1EPHX2
SCHEMBL17792412 0.72 TSHR (0.40) TSHRNPSR1EPHX2
SCHEMBL17792406 0.72 NPSR1 (0.46) TSHRNPSR1EPHX2
SCHEMBL4340777 0.72 NPSR1 (0.47) TSHRNPSR1EPHX2
SCHEMBL1397825 0.72 NPSR1 (0.47) TSHRNPSR1EPHX2
SCHEMBL17795906 0.71 TSHR (0.40) TSHRNPSR1EPHX2
SCHEMBL17792421 0.70 NPSR1 (0.47) TSHRNPSR1EPHX2
SCHEMBL17792403 0.70 NPSR1 (0.39) TSHRNPSR1EPHX2

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-20120164574-A1 ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, AND ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE FILM AND PATTERN FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2012-06-28 US disclosed