SCHEMBL11417633

SCHEMBL11417633

Cc1ccc(NC(=O)Nc2ccc(C)c(S(=O)(=O)Nc3ccc(C)c(S(=O)(=O)Nc4ccc(S(=O)(=O)O)c5cc(S(=O)(=O)O)cc(S(=O)(=O)O)c45)c3)c2)cc1S(=O)(=O)Nc1ccc(C)c(S(=O)(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TIMP3 P35625 4/20 0.59
▸ HPSE Q9Y251 4/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ USP2 O75604 2/20 0.59
▸ RECQL P46063 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ TDP1 Q9NUW8 2/20 0.59
▸ ENPP3 O14638 1/20 0.59
▸ ENTPD3 O75355 1/20 0.59
▸ NR1I2 O75469 1/20 0.59
▸ PRKD3 O94806 1/20 0.59
▸ TDP2 O95551 1/20 0.59
▸ CBX7 O95931 1/20 0.59
▸ NSD2 O96028 1/20 0.59
▸ ESR1 P03372 1/20 0.59
▸ PRKCG P05129 1/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ PRKCB P05771 1/20 0.59
▸ HTR1A P08908 1/20 0.59

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
SCHEMBL11437498 0.91 TIMP3 (0.59) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11415433 0.91 TIMP3 (0.59) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11510973 0.88 P2RY11 (0.76) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11411302 0.88 TIMP3 (0.46) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11431457 0.85 IDH1 (0.55) IDH1
SCHEMBL11439372 0.85 HPSE (0.58) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11407754 0.84 TIMP3 (0.50) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11468130 0.83 TIMP3 (0.49) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11406002 0.82 KMT2A (0.66) TIMP3HPSEMEN1USP2RECQL
SCHEMBL11411036 0.82 TIMP3 (0.47) TIMP3HPSEMEN1USP2RECQL

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-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 claimed
US-4231958-A AMINOPHENYLENECARBONYL /AND SULFONYL/IMINONAPHTHALENE INTERMEDIATES AMERICAN CYANAMID COMPANY (US) 1980-11-04 — — US disclosed
US-4229370-A INHIBITORS OF THE COMPLEMENT SYSTEM, IMMUNOLOGY AMERICAN CYANAMID COMPANY (US) 1980-10-21 — — US disclosed
US-4155930-A Ureylene phenylene anionic naphthalenesulfonic acids AMERICAN CYANAMID COMPANY (US) 1979-05-22 — — US disclosed
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