SCHEMBL11415799

SCHEMBL11415799

Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NHERF1 O14745 1/20 0.46
▸ MCL1 Q07820 1/20 0.43
▸ CRHBP P24387 2/20 0.43
▸ CRHR2 Q13324 2/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ NFKBIA P25963 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ CYTH2 Q99418 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPT P10636 3/20 0.40
▸ LMNA P02545 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ SLC5A1 P13866 1/20 0.40
▸ NCOA1 Q15788 1/20 0.40
▸ NCOA3 Q9Y6Q9 1/20 0.40
▸ GUSB P08236 1/20 0.39
▸ POLB P06746 3/20 0.39
▸ IDH1 O75874 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
SCHEMBL11405692 0.95 IDH1 (0.42) NHERF1MCL1CRHBPCRHR2HSP90AA1
SCHEMBL11415802 0.91 NFKBIA (0.52) NHERF1MCL1CRHBPCRHR2HSP90AA1
SCHEMBL11406040 0.87 IDH1 (0.48) NFKBIARELASMN1; SMN2MAPTLMNA
SCHEMBL11437291 0.86 MAPT (0.44) MCL1SMN1; SMN2MAPTLMNAMEN1
SCHEMBL11411708 0.86 NHERF1 (0.47) NHERF1MCL1CRHBPCRHR2HSP90AA1
SCHEMBL11437748 0.83 ALDH1A1 (0.41) CRHBPCRHR2NFKBIARELASMN1; SMN2
SCHEMBL11432314 0.83 SMN1; SMN2 (0.51) NHERF1MCL1NFKBIARELASMN1; SMN2
SCHEMBL11412345 0.82 DDX3X (0.57) NFKBIARELAMAPTLMNAMEN1
SCHEMBL11412516 0.82 NT5E (0.42) MAPTMEN1HTTKMT2APOLB
SCHEMBL11514077 0.81 RAB9A (0.44) SMN1; SMN2MAPTLMNAMEN1HTT

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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