SCHEMBL8631402

SCHEMBL8631402

CCOc1ccc(-c2c[nH]nc2NS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
RXFP1 Q9HBX9 1/20 0.52
LMNA P02545 5/20 0.50
KDM4E B2RXH2 2/20 0.50
SQSTM1 Q13501 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NPSR1 Q6W5P4 1/20 0.47
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 2/20 0.45
GAA P10253 2/20 0.45
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
SLC40A1 Q9NP59 1/20 0.45
PKM P14618 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL8759590 0.94 KMT2A (0.52) MAPTKMT2AMEN1RXFP1LMNA
SCHEMBL8632624 0.91 SMN1; SMN2 (0.48) MAPTKMT2AMEN1RXFP1LMNA
SCHEMBL8632208 0.86 STAT3 (0.51) MAPTKMT2ALMNASQSTM1KEAP1
SCHEMBL8632286 0.85 KIT (0.45) MAPTKMT2AMEN1RXFP1LMNA
SCHEMBL8632837 0.84 LMNA (0.51) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL8627973 0.81 KDM1A (0.51) MAPTKMT2AMEN1RXFP1LMNA
SCHEMBL8631178 0.81 STAT3 (0.47) MAPTKMT2AMEN1RXFP1LMNA
SCHEMBL8634763 0.81 NAT1 (0.45) MAPTKMT2AMEN1RXFP1KDM4E
SCHEMBL8632960 0.81 KEAP1 (0.51) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL8631560 0.81 SLC40A1 (0.44) MAPTTP53SLC40A1

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-5756530-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G. D. SEARLE & CO. (US) 1998-05-26 US disclosed