SCHEMBL9116444

SCHEMBL9116444

COc1ccc(N(C)S(=O)(=O)c2ccc(OC)c(C(=O)O)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.56
MAPT P10636 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 3/20 0.51
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 1/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49
KDM4E B2RXH2 1/20 0.48
HPGD P15428 2/20 0.48

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
SCHEMBL9049128 0.90 SIRT2 (0.47) PGRMAPTKMT2ASMN1; SMN2LMNA
SCHEMBL9049481 0.90 LMNA (0.55) PGRMAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL9047016 0.89 HSD17B10 (0.56) MAPTALDH1A1KMT2ALMNAKDM4E
SCHEMBL28939174 0.86 PGR (0.55) PGRMAPTL3MBTL1ALDH1A1KMT2A
SCHEMBL9053739 0.85 KMT2A (0.54) PGRL3MBTL1ALDH1A1KMT2ALMNA
SCHEMBL9054120 0.85 SIRT2 (0.52) KMT2A
SCHEMBL8189741 0.82 MAPT (0.60) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL9045528 0.80 PDE4A (0.47) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL664705 0.80 PGR (0.68) PGRMAPTL3MBTL1ALDH1A1KMT2A
SCHEMBL9049287 0.80 LMNA (0.53) PGRMAPTALDH1A1KMT2ASMN1; 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-1995016674-A1 AMINOSULPHONYL-PHENYL-1H-PYRROLE DERIVATIVES, METHOD OF THEIR PREPARATION AND THEIR USE SMITHKLINE BEECHAM PLC (GB) 1995-06-22 WO disclosed