SCHEMBL9455397

SCHEMBL9455397

OCC(C(CO)C(F)(F)F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 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
SCHEMBL4639513 0.83
SCHEMBL12552379 0.81 TSHR (0.37)
SCHEMBL10443954 0.81 TSHR (0.37)
SCHEMBL19271202 0.81 TSHR (0.37)
SCHEMBL1335763 0.78 TDP1 (0.40) CETP
SCHEMBL22264021 0.78 CETP (0.38) CETP
SCHEMBL28866105 0.76 CETP (0.31) CETP
SCHEMBL18481420 0.71 AKR1B1 (0.33)
SCHEMBL28772763 0.71 HTT (0.32) CETP
SCHEMBL21735532 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5078306-A None JP disclosed
JP-H0578306-A 1,4-BIS(PARA-TOLUENESULFONYLOXY)-2,3-BIS(TRIFLUOROMETHYL) BUTANE AND ITS PRODUCTION TOAGOSEI CHEM IND CO LTD 1993-03-30 JP disclosed