SCHEMBL10909698

SCHEMBL10909698

Cc1ccc(NC(=O)C(=O)Nc2ccc(C)c(C(=O)Nc3ccc(O)c4cccc(S(=O)(=O)O)c34)c2)cc1C(=O)Nc1ccc(O)c2cccc(S(=O)(=O)O)c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
TIMP3 P35625 3/20 0.45
RECQL P46063 3/20 0.45
HSD17B10 Q99714 3/20 0.45
TDP1 Q9NUW8 3/20 0.45
HPSE Q9Y251 2/20 0.45
USP2 O75604 2/20 0.45
MAPT P10636 2/20 0.45
PKM P14618 2/20 0.45
BRCA1 P38398 2/20 0.45
SIRT2 Q8IXJ6 2/20 0.45
SIRT1 Q96EB6 2/20 0.45
ENPP3 O14638 1/20 0.45
ENTPD3 O75355 1/20 0.45
NR1I2 O75469 1/20 0.45
PRKD3 O94806 1/20 0.45
TDP2 O95551 1/20 0.45
CBX7 O95931 1/20 0.45
NSD2 O96028 1/20 0.45

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
SCHEMBL10907741 0.96 MEN1 (0.45) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL11341037 0.94 KMT2A (0.52) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL10909458 0.94 SNCA (0.42) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL11346722 0.89 RECQL (0.52) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL10905258 0.88 TIMP3 (0.44) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL10907476 0.88 TIMP3 (0.46) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL11344331 0.87 HPSE (0.47) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL10909169 0.85 CD40 (0.45) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL10907522 0.85 HPSE (0.41) MEN1KMT2ATIMP3RECQLHSD17B10
SCHEMBL10909172 0.85 LMNA (0.43) MEN1KMT2ATIMP3RECQLHSD17B10

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-4599204-A Oxalylamides useful as dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-08 US disclosed