SCHEMBL13345239

SCHEMBL13345239

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

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
MMP8 P22894 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 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
SCHEMBL10247797 0.87 MMP8 (0.33) MMP8
SCHEMBL13980397 0.86 USP2 (0.33) USP2MAPTTSHRCYP1A2CYP2C19
SCHEMBL10226723 0.80 HTT (0.42) MMP8
SCHEMBL23963386 0.77 TSHR (0.37) USP2MAPTTSHRCYP1A2CYP2C19
SCHEMBL25517270 0.77 MMP8 (0.31) MMP8
SCHEMBL24224884 0.76 MMP8 (0.39) MMP8
SCHEMBL13744093 0.76 TSHR (0.36) USP2MAPTTSHRCYP1A2CYP2C19
SCHEMBL2682071 0.76 TSHR (0.36) USP2MAPTTSHRCYP1A2CYP2C19
SCHEMBL19762888 0.75 MAPT (0.39) USP2MAPTTSHRCYP1A2CYP2C19
SCHEMBL891445 0.74 TSHR (0.33) USP2MAPTTSHRCYP1A2CYP2C19

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
WO-2010067898-A2 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION AND PATTERN FORMING METHOD USING THE COMPOSITION FUJIFILM CORPORATION (JP) 2010-06-17 WO disclosed