SCHEMBL14536330

SCHEMBL14536330

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

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL14536327 1.00 USP2 (0.40) USP2MAPTTSHRCYP1A2CYP2C9
SCHEMBL19574820 0.79 TSHR (0.44) USP2MAPTTSHRCYP1A2CYP2C9
SCHEMBL14719714 0.78 TSHR (0.48) USP2MAPTTSHRCYP1A2CYP2C9
SCHEMBL12309007 0.78 HTT (0.47)
SCHEMBL14536326 0.77 TSHR (0.35) USP2MAPTTSHRCYP1A2CYP2C19
SCHEMBL22355118 0.77 USP2 (0.40) USP2MAPTTSHRCYP1A2CYP2C9
SCHEMBL14522643 0.76 TSHR (0.47) USP2MAPTTSHRCYP1A2CYP2C9
SCHEMBL20781252 0.75 USP2 (0.41) USP2MAPTTSHRCYP1A2CYP2C9
SCHEMBL14536155 0.75 TSHR (0.39) USP2MAPTTSHRCYP1A2CYP2C9
SCHEMBL14536412 0.75 TSHR (0.39) USP2MAPTTSHRCYP1A2CYP2C9

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-20070122741-A1 Resist protective coating material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-05-31 US disclosed