SCHEMBL4601809

SCHEMBL4601809

COCCOc1ccc(CN(Cc2ccccc2)S(=O)(=O)OC(N)=O)c(Oc2ncc(C(F)(F)F)cc2Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.60
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL4601402 0.89 PPARG (0.56) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL4601583 0.88 PPARG (0.63) PPARG
SCHEMBL4601769 0.86 PPARG (0.58) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL4601962 0.86 PPARG (0.58) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL4615327 0.85 PPARG (0.56) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL4601288 0.84 PPARG (0.55) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL4600015 0.83 PPARG (0.55) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL4602789 0.83 PPARG (0.55) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL4601293 0.83 PPARG (0.54) PPARGLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL3206547 0.82 PPARG (0.62) PPARGLMNASMN1; SMN2ALDH1A1HPGD

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
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 WO disclosed