SCHEMBL11465116

SCHEMBL11465116

Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.68
KMT2A Q03164 5/20 0.68
TIMP3 P35625 4/20 0.68
HPSE Q9Y251 4/20 0.68
RECQL P46063 3/20 0.68
HSD17B10 Q99714 3/20 0.68
TDP1 Q9NUW8 3/20 0.68
PKM P14618 3/20 0.68
MAPT P10636 3/20 0.68
P2RY11 Q96G91 2/20 0.68
USP2 O75604 2/20 0.68
BRCA1 P38398 2/20 0.68
SIRT2 Q8IXJ6 2/20 0.68
SIRT1 Q96EB6 2/20 0.68
CYP1A2 P05177 2/20 0.68
ENPP3 O14638 1/20 0.68
ENTPD3 O75355 1/20 0.68
NR1I2 O75469 1/20 0.68
PRKD3 O94806 1/20 0.68
TDP2 O95551 1/20 0.68

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
SCHEMBL3300801 0.97 MEN1 (0.64) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL26983156 0.96 MEN1 (0.62) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL11407455 0.90 TIMP3 (0.67) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL11413353 0.89 TIMP3 (0.59) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL6362876 0.88 KMT2A (0.73) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL11426635 0.87 TIMP3 (0.57) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL11510571 0.87 P2RY11 (0.83) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL11416494 0.87 KMT2A (0.63) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL11418806 0.87 TIMP3 (0.63) MEN1KMT2ATIMP3HPSERECQL
SCHEMBL17903246 0.86 TIMP3 (0.58) MEN1KMT2ATIMP3HPSERECQL

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
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-4180587-A Ureylene phenylene anionic naphthalenesulfonic acids as complement inhibitors AMERICAN CYANAMID COMPANY (US) 1979-12-25 US disclosed