SCHEMBL8664933

SCHEMBL8664933

Cc1cc(-c2ccccc2NS(=O)(=O)c2ccccc2)ccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
MCOLN3 Q8TDD5 3/20 0.58
CA12 O43570 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
ALDH1A1 P00352 6/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
USP2 O75604 1/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
NOD2 Q9HC29 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 3/20 0.51
ALOX15 P16050 3/20 0.51
HSD17B10 Q99714 3/20 0.51
HPGD P15428 1/20 0.51

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
SCHEMBL8657888 0.89 ALDH1A1 (0.61) LMNAMCOLN3CA12CA2CA9
SCHEMBL8662804 0.89 PTGES2 (0.61) LMNAMCOLN3CA12CA2CA9
SCHEMBL8663401 0.87 ALDH1A1 (0.74) LMNAMCOLN3CA12CA2CA9
SCHEMBL8658333 0.86 STAT3 (0.59) LMNAMCOLN3CA12CA2CA9
SCHEMBL8660227 0.86 MCOLN3 (0.61) LMNAMCOLN3CA12CA2CA9
SCHEMBL8663484 0.85 PTGS2 (0.56) LMNAALDH1A1MEN1KMT2AGAA
SCHEMBL8659130 0.84 MCOLN3 (0.66) LMNAMCOLN3CA12CA2CA9
SCHEMBL8661197 0.84 STAT3 (0.62) LMNAMCOLN3CA12CA2CA9
SCHEMBL8661254 0.83 MCOLN3 (0.61) LMNAMCOLN3CA12CA2CA9
SCHEMBL8659787 0.83 MEN1 (0.60) LMNAMCOLN3CA12CA2CA9

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-5739166-A ALKYLSULFONYL OR AMINOSULFONYL SUBSTITUTED AROMATIC COMPOUNDS AS NON-STEROIDAL ANTIINFLAMMATORY AGENT G.D. SEARLE & CO. (US) 1998-04-14 US disclosed