SCHEMBL11634224

SCHEMBL11634224

O=C(Nc1cccc(C(=O)Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c1S(=O)(=O)O)Nc1cccc(C(=O)Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c1S(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 1/20 0.48
▸ TIMP3 P35625 5/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ USP2 O75604 2/20 0.47
▸ RECQL P46063 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HPSE Q9Y251 4/20 0.43
▸ PRMT1 Q99873 2/20 0.43
▸ ENPP3 O14638 1/20 0.43
▸ ENTPD3 O75355 1/20 0.43
▸ NR1I2 O75469 1/20 0.43
▸ PRKD3 O94806 1/20 0.43
▸ TDP2 O95551 1/20 0.43
▸ CBX7 O95931 1/20 0.43
▸ NSD2 O96028 1/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ PRKCG P05129 1/20 0.43

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
SCHEMBL11632695 0.87 APEX1 (0.47) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11634127 0.85 TIMP3 (0.56) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11635735 0.84 APEX1 (0.44) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11633419 0.84 APEX1 (0.44) APEX1TIMP3MEN1USP2RECQL
SCHEMBL10898136 0.83 APEX1 (0.49) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11512944 0.81 TIMP3 (0.52) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11431817 0.80 TIMP3 (0.55) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11432335 0.80 TIMP3 (0.52) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11418759 0.79 TIMP3 (0.54) APEX1TIMP3MEN1USP2RECQL
SCHEMBL11514021 0.79 TIMP3 (0.72) APEX1TIMP3MEN1USP2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4129590-A INHIBITORS OF THE COMPLEMENT SYSTEM AMERICAN CYANAMID COMPANY (US) 1978-12-12 — — US disclosed
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