SCHEMBL11418806

SCHEMBL11418806

Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)cc1NC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 5/20 0.63
KMT2A Q03164 4/20 0.63
HPSE Q9Y251 4/20 0.63
MEN1 O00255 3/20 0.63
RECQL P46063 3/20 0.63
HSD17B10 Q99714 3/20 0.63
TDP1 Q9NUW8 3/20 0.63
MAPT P10636 3/20 0.63
P2RY11 Q96G91 2/20 0.63
USP2 O75604 2/20 0.63
PKM P14618 2/20 0.63
BRCA1 P38398 2/20 0.63
SIRT2 Q8IXJ6 2/20 0.63
SIRT1 Q96EB6 2/20 0.63
ENPP3 O14638 1/20 0.63
ENTPD3 O75355 1/20 0.63
NR1I2 O75469 1/20 0.63
PRKD3 O94806 1/20 0.63
TDP2 O95551 1/20 0.63
CBX7 O95931 1/20 0.63

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
SCHEMBL11407455 0.96 TIMP3 (0.67) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11443813 0.91 KMT2A (0.52) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL6362876 0.90 KMT2A (0.73) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11438233 0.88 TIMP3 (0.60) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11593396 0.88 TIMP3 (0.63) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11466093 0.88 TIMP3 (0.67) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11414391 0.87 RECQL (0.80) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11465116 0.87 MEN1 (0.68) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11413353 0.86 TIMP3 (0.59) TIMP3KMT2AHPSEMEN1RECQL
SCHEMBL11477425 0.86 P2RY11 (0.79) TIMP3KMT2AHPSEMEN1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0008154-A1 Ureylene phenylene anionic naphthalene-sulfonic acids, their use as complement system inhibitors in a body fluid and process for their preparation AMERICAN CYANAMID COMPANY (US) 1980-02-20 EP disclosed
US-4185033-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1980-01-22 US disclosed