SCHEMBL11415482

SCHEMBL11415482

Cc1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)cc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 3/20 0.54
▸ ALDH1A1 P00352 9/20 0.52
▸ PKM P14618 2/20 0.52
▸ MAPK1 P28482 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ CCKBR P32239 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ TIMP3 P35625 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ ENPP3 O14638 1/20 0.46
▸ ENTPD3 O75355 1/20 0.46
▸ NR1I2 O75469 1/20 0.46
▸ USP2 O75604 1/20 0.46
▸ PRKD3 O94806 1/20 0.46
▸ TDP2 O95551 1/20 0.46
▸ CBX7 O95931 1/20 0.46
▸ NSD2 O96028 1/20 0.46
▸ ESR1 P03372 1/20 0.46

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
SCHEMBL11415400 0.86 MEN1 (0.51) CCR2ALDH1A1PKMMAPK1CCKBR
SCHEMBL11422060 0.86 MEN1 (0.48) CCR2ALDH1A1PKMMAPK1MAPT
SCHEMBL11415488 0.86 MEN1 (0.48) CCR2ALDH1A1PKMMAPK1MAPT
SCHEMBL11470061 0.85 TDP1 (0.45) CCR2ALDH1A1PKMMAPK1MAPT
SCHEMBL11415386 0.85 NFKBIA (0.48) ALDH1A1PKMMAPK1MAPTMEN1
SCHEMBL11405798 0.84 TIMP3 (0.47) CCR2ALDH1A1PKMMAPTMEN1
SCHEMBL11411708 0.84 NHERF1 (0.47) ALDH1A1PKMMAPK1KDM4EMAPT
SCHEMBL11414900 0.83 TIMP3 (0.46) CCR2ALDH1A1PKMMAPTMEN1
SCHEMBL3300801 0.83 MEN1 (0.64) ALDH1A1PKMMAPTMEN1TIMP3
SCHEMBL11422058 0.83 CCR2 (0.54) CCR2ALDH1A1PKMMAPK1KDM4E

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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