SCHEMBL11416600

SCHEMBL11416600

Cc1cc(N)ccc1C(=O)Nc1ccc(S(=O)(=O)Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 2/20 0.42
▸ CTDSP1 Q9GZU7 1/20 0.42
▸ TIMP3 P35625 3/20 0.40
▸ HPSE Q9Y251 2/20 0.39
▸ ENPP2 Q13822 5/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ MAPT P10636 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ GPR27 Q9NS67 5/20 0.39
▸ RECQL P46063 3/20 0.39
▸ TDP1 Q9NUW8 3/20 0.39
▸ USP2 O75604 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ ENPP3 O14638 1/20 0.39
▸ ENTPD3 O75355 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ TDP2 O95551 1/20 0.39

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
SCHEMBL11432038 0.94 CASP6 (0.40) CASP6CTDSP1TIMP3HPSEENPP2
SCHEMBL11402861 0.89 ALDH1A1 (0.40) CASP6HPSEMEN1KMT2AMAPT
SCHEMBL11407773 0.88 TIMP3 (0.52) CASP6CTDSP1TIMP3HPSEENPP2
SCHEMBL11412516 0.87 NT5E (0.42) CASP6ENPP2MEN1KMT2AMAPT
SCHEMBL11432048 0.87 CASP6 (0.40) CASP6CTDSP1TIMP3HPSEENPP2
SCHEMBL11416598 0.87 CASP6 (0.41) CASP6CTDSP1TIMP3HPSEENPP2
SCHEMBL11513047 0.85 APEX1 (0.45) CASP6CTDSP1TIMP3HPSEENPP2
SCHEMBL11468128 0.83 TIMP3 (0.50) CASP6CTDSP1TIMP3HPSEENPP2
SCHEMBL11440315 0.83 POLB (0.41) CASP6TIMP3HPSEMEN1KMT2A
SCHEMBL11437291 0.82 MAPT (0.44) MEN1KMT2AMAPTKDM4EHTT

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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