SCHEMBL2176486

SCHEMBL2176486

CCc1ccc(S(=O)(=O)N(CC(=O)NCc2cccc(C=CC(=O)O)c2)c2cccc(Cl)c2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 10/20 0.56
THRB P10828 1/20 0.49
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RORC P51449 1/20 0.42

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
SCHEMBL2176483 1.00 PTGER1 (0.56) PTGER1THRBNPC1RAB9ALMNA
SCHEMBL2173616 0.93 PTGER1 (0.55) PTGER1THRBLMNAMEN1KMT2A
SCHEMBL2173610 0.93 PTGER1 (0.55) PTGER1THRBLMNAMEN1KMT2A
SCHEMBL2175487 0.93 PTGER1 (0.59) PTGER1THRBLMNAALDH1A1HPGD
SCHEMBL2175483 0.93 PTGER1 (0.59) PTGER1THRBLMNAALDH1A1HPGD
SCHEMBL13894309 0.92 PTGER1 (0.53) PTGER1THRBNPC1RAB9ALMNA
SCHEMBL13894296 0.91 PTGER1 (0.58) PTGER1THRBNPC1RAB9ALMNA
SCHEMBL2174925 0.90 PTGER1 (0.53) PTGER1THRBLMNAMEN1KMT2A
SCHEMBL2174921 0.90 PTGER1 (0.53) PTGER1THRBLMNAMEN1KMT2A
SCHEMBL12487341 0.89 PTGER1 (0.64) PTGER1THRBNPC1RAB9ALMNA

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-7973078-B2 Sulfonamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2011-07-05 US claimed