SCHEMBL11147311

SCHEMBL11147311

O=C(Nc1ccc(C(=O)Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c(S(=O)(=O)O)c1)c1ccc([N+](=O)[O-])cc1S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CD40 P25942 2/20 0.46
▸ CD40LG P29965 2/20 0.46
▸ ENPP2 Q13822 2/20 0.43
▸ KMT2A Q03164 6/20 0.42
▸ MEN1 O00255 5/20 0.42
▸ TIMP3 P35625 1/20 0.41
▸ MAPT P10636 5/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ APEX1 P27695 1/20 0.40
▸ RAB9A P51151 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ ALDH1A1 P00352 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
SCHEMBL11156385 1.00 CD40 (0.46) CD40CD40LGENPP2KMT2AMEN1
SCHEMBL11440007 0.95 APEX1 (0.44) CD40CD40LGENPP2KMT2AMEN1
SCHEMBL11418896 0.95 APEX1 (0.44) CD40CD40LGENPP2KMT2AMEN1
SCHEMBL11152668 0.95 APEX1 (0.44) CD40CD40LGENPP2KMT2AMEN1
SCHEMBL11418887 0.94 APEX1 (0.43) CD40CD40LGENPP2KMT2AMEN1
SCHEMBL11437296 0.88 MEN1 (0.50) KMT2AMEN1MAPTPOLBGAA
SCHEMBL11433142 0.87 APEX1 (0.56) CD40CD40LGENPP2KMT2AMEN1
SCHEMBL11437291 0.86 MAPT (0.44) CD40CD40LGKMT2AMEN1MAPT
SCHEMBL11432542 0.86 APEX1 (0.44) CD40CD40LGKMT2AMEN1TIMP3
SCHEMBL11442053 0.86 APEX1 (0.44) CD40CD40LGKMT2AMEN1TIMP3

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-4387059-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1983-06-07 — — 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-4185032-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1980-01-22 — — US disclosed
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