SCHEMBL9546078

SCHEMBL9546078

C=C(C(=O)OCC)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(C)F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.30
GAA P10253 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
SCHEMBL9546099 0.88 TSHR (0.32) TSHR
SCHEMBL9546014 0.86 HTT (0.37)
SCHEMBL9546105 0.85 TSHR (0.40) ALDH1A1TSHR
SCHEMBL9546024 0.85 HTT (0.36)
SCHEMBL9546030 0.84
SCHEMBL9546277 0.82
SCHEMBL9546095 0.82 ALDH1A1 (0.33) ALDH1A1GAA
SCHEMBL3149226 0.82 ALDH1A1 (0.40) ALDH1A1TSHRMAPTGAA
SCHEMBL9578254 0.81
SCHEMBL9546017 0.81 TSHR (0.34) TSHRMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993023773-A1 PROCESS FOR PREPARATION OF OXYGEN PERMEABLE POLYMER MATERIAL CIBA-GEIGY AG (CH) 1993-11-25 WO disclosed
US-5235013-A Copolymerizing an alkene of 6-10 carbons having one double bond and a side chain methyl group and an acrylic or fluoroacrylic ester CIBA-GEIGY CORPORATION 1993-08-10 US disclosed
EP-0478261-A2 Process for producing oxygen-permeable polymer CIBA-GEIGY AG (CH) 1992-04-01 EP disclosed