SCHEMBL6464348

SCHEMBL6464348

CCCCCS(=O)(=O)NC(=O)c1ccc2nc(C)n(Cc3ccc(NC(C)CCCC)cc3Cl)c2n1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.56
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL6504715 0.89 PPARG (0.60) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6491323 0.88 PPARG (0.59) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6490809 0.88 PPARG (0.59) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6491902 0.87 PPARG (0.54) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6299715 0.86 PPARG (0.73) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6491134 0.85 PPARG (0.56) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6498488 0.85 PPARG (0.58) PPARG
SCHEMBL6489866 0.85 PPARG (0.61) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6299033 0.85 PPARG (0.61) PPARGALDH1A1MAPTSMN1; SMN2
SCHEMBL6306107 0.85 PPARG (0.61) PPARGALDH1A1MAPTSMN1; SMN2

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-2005082414-A2 CONCOMITANT DRUGS OF A SULFONAMIDE AND ANOTHER THERAPEUTIC AGENT ASTELLAS PHARMA INC. (JP) 2005-09-09 WO disclosed