SCHEMBL11874263

SCHEMBL11874263

CC(=O)NCCc1ccc(S(=O)(=O)NC(=O)NC2CCCC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.69
TSHR P16473 4/20 0.67
LMNA P02545 3/20 0.67
BLM P54132 3/20 0.67
CYP2C9 P11712 3/20 0.67
CYP3A4 P08684 2/20 0.67
MAPT P10636 2/20 0.67
CYP2C19 P33261 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
HTR1A P08908 1/20 0.67
NFKB1 P19838 1/20 0.67
CNR1 P21554 1/20 0.67
ADRA1A P35348 1/20 0.67
ALDH1A1 P00352 4/20 0.62
THRB P10828 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
ATM Q13315 1/20 0.62
ADORA3 P0DMS8 1/20 0.62
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61

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
SCHEMBL11818538 0.91 PPARG (0.62) PPARGTSHRLMNABLMCYP2C9
SCHEMBL28407544 0.90 ATM (0.76) PPARGTSHRLMNABLMCYP2C9
SCHEMBL12857011 0.89 PPARG (0.67) PPARGTSHRLMNABLMCYP2C9
SCHEMBL28407181 0.88 PPARG (0.76) PPARGTSHRLMNABLMCYP2C9
SCHEMBL12869021 0.86 PPARG (0.67) PPARGTSHRLMNABLMCYP2C9
SCHEMBL28465800 0.84 PPARG (0.63) PPARGTSHRLMNABLMCYP2C9
SCHEMBL11881278 0.83 PPARG (0.67) PPARGTSHRLMNABLMCYP2C9
SCHEMBL6135221 0.82 PPARG (0.69) PPARGTSHRLMNABLMCYP2C9
SCHEMBL9102046 0.81 PPARG (0.69) PPARGTSHRLMNABLMCYP2C9
SCHEMBL27513111 0.81 PPARG (1.00) PPARGTSHRLMNABLMCYP2C9

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
US-3932658-A Composition and method for lower blood sugar containing N-[4-(β-<2-methoxy-5-chloro-benzamido>-ethyl)-benzenesulfonyl]-N'-cyclopentyl-urea HOECHST AKTIENGESELLSCHAFT (DT) 1976-01-13 US disclosed