SCHEMBL11412516

SCHEMBL11412516

Cc1cc(N)ccc1S(=O)(=O)Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 2/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ CASP6 P55212 4/20 0.39
▸ NSD2 O96028 2/20 0.39
▸ DUSP3 P51452 1/20 0.39
▸ PTPN5 P54829 1/20 0.39
▸ PTPN11 Q06124 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ RECQL P46063 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ ELAVL1 Q15717 1/20 0.39
▸ SUMO2 P61956 1/20 0.37
▸ SUMO1 P63165 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37

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
SCHEMBL11402861 0.94 ALDH1A1 (0.40) NT5EL3MBTL1CASP6NSD2DUSP3
SCHEMBL11412518 0.91 NT5E (0.42) NT5EL3MBTL1CASP6NSD2DUSP3
SCHEMBL11416600 0.87 CASP6 (0.42) L3MBTL1CASP6NSD2ALDH1A1MEN1
SCHEMBL11402862 0.85 ALDH1A1 (0.43) NT5EL3MBTL1CASP6ALDH1A1MEN1
SCHEMBL11432038 0.85 CASP6 (0.40) NT5EL3MBTL1CASP6NSD2ALDH1A1
SCHEMBL11411033 0.85 TIMP3 (0.46) NT5EL3MBTL1CASP6NSD2DUSP3
SCHEMBL11438958 0.84 NT5E (0.40) NT5ECASP6ALDH1A1MEN1KMT2A
SCHEMBL11412735 0.83 SLC40A1 (0.48) NT5EL3MBTL1CASP6ALDH1A1MEN1
SCHEMBL11415799 0.82 NHERF1 (0.46) L3MBTL1ALDH1A1MEN1KMT2APOLB
SCHEMBL11440315 0.82 POLB (0.41) NT5EL3MBTL1CASP6NSD2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-4229372-A INHIBITORS OF THE COMPLEMENT SYSTEM, IMMUNOLOGY AMERICAN CYANAMID COMPANY (US) 1980-10-21 — — US disclosed
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-4155930-A Ureylene phenylene anionic naphthalenesulfonic acids AMERICAN CYANAMID COMPANY (US) 1979-05-22 — — US disclosed
US-4155931-A COMPLEMENT INHIBITORS FOR MAMMALS AMERICAN CYANAMID COMPANY (US) 1979-05-22 — — US disclosed
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