SCHEMBL11593391

SCHEMBL11593391

Cc1ccc(NC(=O)Nc2cc(C(=O)Nc3cc(S(=O)(=O)O)cc4cc(S(=O)(=O)O)cc(S(=O)(=O)O)c34)cc(C(=O)Nc3cc(S(=O)(=O)O)cc4cc(S(=O)(=O)O)cc(S(=O)(=O)O)c34)c2)cc1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TIMP3 P35625 6/20 0.53
▸ MAPT P10636 6/20 0.49
▸ MEN1 O00255 6/20 0.49
▸ KMT2A Q03164 6/20 0.49
▸ TDP1 Q9NUW8 5/20 0.49
▸ HPSE Q9Y251 4/20 0.49
▸ RECQL P46063 4/20 0.49
▸ HSD17B10 Q99714 4/20 0.49
▸ CYP1A2 P05177 3/20 0.49
▸ PKM P14618 3/20 0.49
▸ BRCA1 P38398 3/20 0.49
▸ P2RX1 P51575 3/20 0.49
▸ USP2 O75604 2/20 0.49
▸ ENPP3 O14638 1/20 0.49
▸ ENTPD3 O75355 1/20 0.49
▸ NR1I2 O75469 1/20 0.49
▸ PRKD3 O94806 1/20 0.49
▸ TDP2 O95551 1/20 0.49
▸ CBX7 O95931 1/20 0.49
▸ NSD2 O96028 1/20 0.49

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
SCHEMBL11512686 0.93 KMT2A (0.59) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11514991 0.91 MAPT (0.56) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11513840 0.91 MAPT (0.53) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11513848 0.91 MAPT (0.53) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11593413 0.88 TIMP3 (0.66) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11512361 0.87 MEN1 (0.55) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11593406 0.87 TIMP3 (0.55) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11515000 0.86 MAPT (0.45) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11589812 0.84 APEX1 (0.56) TIMP3MAPTMEN1KMT2ATDP1
SCHEMBL11595757 0.83 TIMP3 (0.67) TIMP3MAPTMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4108890-A Nitro or amino phenylenebis(carbonylimino)dinaphthalenetrisulfonic compounds as complement inhibitors AMERICAN CYANAMID COMPANY (US) 1978-08-22 — — US disclosed
US-4051176-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1977-09-27 — — US disclosed
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