SCHEMBL11205429

SCHEMBL11205429

O=C(Nc1ccc(C(=O)Nc2ccc3c(S(=O)(=O)O)cccc3c2O)cc1)Nc1ccc(C(=O)Nc2ccc3c(S(=O)(=O)O)cccc3c2O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 6/20 0.56
CD40 P25942 3/20 0.52
CD40LG P29965 3/20 0.52
FGF1 P05230 1/20 0.50
MEN1 O00255 2/20 0.48
USP2 O75604 2/20 0.48
RECQL P46063 2/20 0.48
KMT2A Q03164 2/20 0.48
HSD17B10 Q99714 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HPSE Q9Y251 6/20 0.45
CYP1A2 P05177 2/20 0.45
SIRT1 Q96EB6 2/20 0.45
ENPP3 O14638 1/20 0.45
ENTPD3 O75355 1/20 0.45
NR1I2 O75469 1/20 0.45
PRKD3 O94806 1/20 0.45
TDP2 O95551 1/20 0.45
CBX7 O95931 1/20 0.45

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
SCHEMBL10908939 0.93 CD40 (0.52) TIMP3CD40CD40LGFGF1MEN1
SCHEMBL11335520 0.88 TIMP3 (0.63) TIMP3MEN1USP2RECQLKMT2A
SCHEMBL11355263 0.86 TIMP3 (0.54) TIMP3CD40CD40LGFGF1MEN1
SCHEMBL11433094 0.86 TTR (0.46) TIMP3CD40CD40LGMEN1USP2
SCHEMBL11341705 0.85 FGF1 (0.56) TIMP3CD40CD40LGFGF1MEN1
SCHEMBL11344939 0.84 HPSE (0.49) TIMP3CD40CD40LGMEN1USP2
SCHEMBL11340875 0.83 TIMP3 (0.47) TIMP3CD40CD40LGFGF1MEN1
SCHEMBL11342760 0.83 TIMP3 (0.56) TIMP3CD40CD40LGFGF1MEN1
SCHEMBL11342795 0.83 CD40 (0.58) TIMP3CD40CD40LGFGF1MEN1
SCHEMBL11761700 0.83 TIMP3 (0.68) TIMP3CD40CD40LGFGF1MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0013784-B1 C-SUBSTITUTED NAPHTHALENEMONOSULFONIC UREIDES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMERICAN CYANAMID COMPANY (US) 1983-02-23 EP disclosed
US-4297372-A ANTIARTHRITIC AGENTS; COLLAGENASE AND PROTEOLYTIC ENZYME INHIBITORS; BONE, SKIN, AND ORAL DISORDERS AMERICAN CYANAMID COMPANY (US) 1981-10-27 US disclosed
EP-0013784-A1 C-Substituted naphthalenemonosulfonic ureides, process for their preparation and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1980-08-06 EP disclosed
US-4216164-A Ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 US disclosed