SCHEMBL10907786

SCHEMBL10907786

Cc1ccc(NC(=O)C(=O)Nc2ccc(C)c(C(=O)Nc3cc(S(=O)(=O)O)cc4ccc(O)cc34)c2)cc1C(=O)Nc1cc(S(=O)(=O)O)cc2ccc(O)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.44
▸ PRMT1 Q99873 2/20 0.41
▸ ENPP2 Q13822 3/20 0.40
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ CASP6 P55212 2/20 0.38
▸ CTDSP1 Q9GZU7 1/20 0.38
▸ PTGES O14684 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ BLK P51451 1/20 0.37
▸ BTK Q06187 1/20 0.37
▸ LDLR P01130 1/20 0.37
▸ TRPV1 Q8NER1 1/20 0.37
▸ NSD2 O96028 3/20 0.37
▸ USP2 O75604 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ HPSE Q9Y251 2/20 0.37
▸ MEN1 O00255 1/20 0.37

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
SCHEMBL11417274 0.94 PRMT1 (0.49) NT5EPRMT1ENPP2MAPTTRPV1
SCHEMBL10908562 0.92 PRMT1 (0.46) NT5EPRMT1ENPP2LMNAMAPT
SCHEMBL11346336 0.85 PRMT1 (0.55) NT5EPRMT1ENPP2MAPTCASP6
SCHEMBL10908622 0.85 ENPP2 (0.43) NT5EENPP2LMNAMAPTPOLB
SCHEMBL11512326 0.84 TIMP3 (0.45) NT5EPRMT1ENPP2LMNAMAPT
SCHEMBL10909518 0.84 NT5E (0.61) NT5EPRMT1ENPP2LMNAMAPT
SCHEMBL10905209 0.83 ENPP2 (0.51) NT5EPRMT1ENPP2CASP6CTDSP1
SCHEMBL10908090 0.83 PRMT1 (0.46) NT5EPRMT1ENPP2LMNAMAPT
SCHEMBL10907727 0.83 ENPP2 (0.45) NT5EPRMT1ENPP2LMNACASP6
SCHEMBL10907835 0.82 MAOB (0.40) PRMT1LMNAMAPTPOLBMAOB

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
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