SCHEMBL9129394

SCHEMBL9129394

Cc1ccc(S(=O)(=O)NCCc2cccc(OCC(=O)NCc3ccccc3)c2)cc1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SGMS1 Q86VZ5 9/20 0.74
L3MBTL1 Q9Y468 1/20 0.63
ALDH1A1 P00352 2/20 0.56
USP2 O75604 1/20 0.55
HPGD P15428 1/20 0.53
KMT2A Q03164 1/20 0.53
RAB9A P51151 1/20 0.53
MAPT P10636 1/20 0.52
CYP2C19 P33261 1/20 0.52
HTT P42858 1/20 0.52
LMNA P02545 1/20 0.52

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
SCHEMBL9129388 0.87 TBXA2R (0.62) SGMS1L3MBTL1ALDH1A1KMT2AMAPT
SCHEMBL9617068 0.83 SGMS1 (0.63) SGMS1ALDH1A1LMNA
SCHEMBL9130159 0.82 DRD4 (0.55) SGMS1L3MBTL1ALDH1A1KMT2ARAB9A
SCHEMBL9128157 0.81 LMNA (0.57) SGMS1L3MBTL1ALDH1A1USP2HPGD
SCHEMBL9130577 0.81 SGMS1 (0.64) SGMS1HTT
SCHEMBL9813017 0.81 TBXA2R (0.75) SGMS1ALDH1A1MAPTHTT
SCHEMBL9850482 0.80 SGMS1 (0.66) SGMS1
SCHEMBL30949337 0.80 SGMS1 (1.00) SGMS1ALDH1A1HTT
SCHEMBL10773841 0.78 ALDH1A1 (0.66) SGMS1ALDH1A1KMT2AHTTLMNA
SCHEMBL14142894 0.78 ALDH1A1 (0.87) L3MBTL1ALDH1A1USP2KMT2ARAB9A

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-5446065-A Thromboxane antagonists BOEHRINGER MANNHEIM GMBH (DE) 1995-08-29 US disclosed