SCHEMBL11425899

SCHEMBL11425899

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 4/20 0.56
POLB P06746 1/20 0.54
MEN1 O00255 9/20 0.54
KMT2A Q03164 9/20 0.54
ALDH1A1 P00352 3/20 0.54
RECQL P46063 3/20 0.54
USP2 O75604 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
MAPT P10636 4/20 0.53
HPGD P15428 1/20 0.53
HPSE Q9Y251 4/20 0.50
ENPP3 O14638 1/20 0.50
ENTPD3 O75355 1/20 0.50
NR1I2 O75469 1/20 0.50
PRKD3 O94806 1/20 0.50
TDP2 O95551 1/20 0.50
CBX7 O95931 1/20 0.50
NSD2 O96028 1/20 0.50
ESR1 P03372 1/20 0.50

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
SCHEMBL11407259 0.99 TIMP3 (0.55) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11593396 0.93 TIMP3 (0.63) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11424528 0.88 POLB (0.49) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11426572 0.88 TIMP3 (0.52) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11407455 0.87 TIMP3 (0.67) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11426622 0.86 TIMP3 (0.60) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11438233 0.86 TIMP3 (0.60) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11430062 0.85 TIMP3 (0.59) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL11426635 0.84 TIMP3 (0.57) TIMP3POLBMEN1KMT2AALDH1A1
SCHEMBL30388456 0.84 KMT2A (0.69) TIMP3POLBMEN1KMT2AALDH1A1

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 3 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
US-4185032-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1980-01-22 US disclosed