SCHEMBL11414908

SCHEMBL11414908

Cc1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c(N)c1.[Na].[Na].[Na]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 4/20 0.47
▸ TIMP3 P35625 4/20 0.46
▸ MEN1 O00255 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ RECQL P46063 3/20 0.44
▸ TDP1 Q9NUW8 3/20 0.44
▸ HSD17B10 Q99714 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ USP2 O75604 2/20 0.44
▸ APP P05067 1/20 0.43
▸ HPSE Q9Y251 4/20 0.43
▸ MAPT P10636 2/20 0.43
▸ ENPP3 O14638 1/20 0.43
▸ ENTPD3 O75355 1/20 0.43
▸ NR1I2 O75469 1/20 0.43
▸ PRKD3 O94806 1/20 0.43
▸ TDP2 O95551 1/20 0.43
▸ CBX7 O95931 1/20 0.43
▸ NSD2 O96028 1/20 0.43
▸ ESR1 P03372 1/20 0.43

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
SCHEMBL11405828 1.00 SLC40A1 (0.47) SLC40A1TIMP3MEN1KMT2ARECQL
SCHEMBL11481702 0.88 TIMP3 (0.50) SLC40A1TIMP3MEN1KMT2ARECQL
SCHEMBL11405673 0.86 TIMP3 (0.48) SLC40A1TIMP3MEN1KMT2ARECQL
SCHEMBL11412735 0.85 SLC40A1 (0.48) SLC40A1MEN1KMT2ARECQLTDP1
SCHEMBL11411033 0.84 TIMP3 (0.46) TIMP3MEN1KMT2ARECQLTDP1
SCHEMBL11405798 0.83 TIMP3 (0.47) TIMP3MEN1KMT2ARECQLTDP1
SCHEMBL11411036 0.83 TIMP3 (0.47) TIMP3MEN1KMT2ARECQLTDP1
SCHEMBL11422060 0.82 MEN1 (0.48) TIMP3MEN1KMT2ARECQLTDP1
SCHEMBL11415488 0.82 MEN1 (0.48) TIMP3MEN1KMT2ARECQLTDP1
SCHEMBL11414900 0.82 TIMP3 (0.46) TIMP3MEN1KMT2ARECQLTDP1

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
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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