SCHEMBL9546069

SCHEMBL9546069

C=C(C(=O)OC(C)(C)C(F)(F)C(F)(F)C(F)(F)C(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(C)F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 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
SCHEMBL9578279 0.93 KDM4E (0.31) KDM4ETSHRTDP1
SCHEMBL9546039 0.81
SCHEMBL13379314 0.81 TSHR (0.35) KDM4ETSHRTDP1GAA
SCHEMBL8374004 0.80 GAA (0.35) KDM4ETSHRTDP1GAA
SCHEMBL9546095 0.80 ALDH1A1 (0.33) GAA
SCHEMBL9546017 0.79 TSHR (0.34) KDM4ETSHRTDP1GAA
SCHEMBL9578427 0.78 TSHR (0.39) KDM4ETSHRTDP1GAA
SCHEMBL9578270 0.78 TSHR (0.39) KDM4ETSHRTDP1GAA
SCHEMBL9578419 0.78 GAA (0.35) KDM4ETSHRTDP1GAA
SCHEMBL9546071 0.77

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