SCHEMBL27848106

SCHEMBL27848106

Cc1ccc(F)cc1S(=O)(=O)N1CCOc2ccc(C(=O)NCCc3ccc(C(=O)O)c(F)c3)cc21

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 11/20 0.56
CPT1B Q92523 10/20 0.56
CPT2 P23786 8/20 0.56
RAB9A P51151 1/20 0.48
LMNA P02545 3/20 0.47
ALDH1A1 P00352 1/20 0.47
THRB P10828 1/20 0.47
TDP1 Q9NUW8 1/20 0.44
HTT P42858 1/20 0.42
MYC P01106 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.41

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
SCHEMBL27865184 0.92 RAB9A (0.53) CPT1ACPT1BCPT2RAB9ALMNA
SCHEMBL27865245 0.86 CPT1A (0.63) CPT1ACPT1BCPT2RAB9ALMNA
SCHEMBL750796 0.86 CPT1A (0.75) CPT1ACPT1BCPT2
SCHEMBL27848103 0.80 CPT1A (0.60) CPT1ACPT1BCPT2LMNAALDH1A1
SCHEMBL752797 0.80 CPT1A (0.64) CPT1ACPT1BCPT2THRBMAPT
SCHEMBL752830 0.78 CPT1A (0.73) CPT1ACPT1BCPT2
SCHEMBL753256 0.78 CPT1A (0.62) CPT1ACPT1BCPT2RAB9AALDH1A1
SCHEMBL27731306 0.78 CPT1A (0.59) CPT1ACPT1BCPT2RAB9ALMNA
SCHEMBL27731307 0.76 CPT1A (0.63) CPT1ACPT1BCPT2RAB9AALDH1A1
SCHEMBL1261499 0.75 MAPT (0.61) CPT1ACPT1BCPT2RAB9ALMNA

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
CN-101379044-B Heterobicyclic sulfonamide derivatives for the treatment of diabetes HOFFMANN LA ROCHE 2012-04-11 CN disclosed