SCHEMBL8745187

SCHEMBL8745187

C=Cc1ccc(CC(CCC(=O)O)C(=O)O)cc1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CPA3 P15088 2/20 0.66
FOLH1 Q04609 7/20 0.51
CYP1A2 P05177 1/20 0.44
NAALAD2 Q9Y3Q0 1/20 0.44
CPA1 P15085 2/20 0.44
CPB1 P15086 1/20 0.44
CPB2 Q96IY4 1/20 0.44

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
SCHEMBL17537902 0.87 CPA3 (0.85) CPA3FOLH1CYP1A2NAALAD2CPA1
SCHEMBL7093743 0.84 CPA1 (0.64) CPA3FOLH1CYP1A2CPA1CPB1
SCHEMBL8745128 0.80 FOLH1 (0.45) CPA3FOLH1
SCHEMBL3963424 0.80 CPA3 (1.00) CPA3FOLH1CYP1A2NAALAD2CPA1
SCHEMBL29088272 0.80 CPA3 (1.00) CPA3FOLH1CYP1A2NAALAD2CPA1
SCHEMBL11590416 0.79 CPA3 (0.72) CPA3FOLH1CYP1A2NAALAD2CPA1
SCHEMBL17693401 0.79 CPA3 (0.72) CPA3FOLH1CYP1A2NAALAD2CPA1
SCHEMBL8745143 0.78 CPA3 (0.40) CPA3FOLH1
SCHEMBL3627111 0.78 FFAR1 (0.59)
SCHEMBL5146874 0.78 LDHA (0.52) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0466220-B1 Carboxy containing monomers and polymers and latices prepared from same JOHNSON & JOHNSON CLIN DIAG (US) 1997-01-29 EP claimed
EP-0462670-B1 Use of 1-(1-pyrrolidinylcarbonyl)pyridinium salts to attach compounds to caboxylated particles & a kit containing same JOHNSON & JOHNSON CLIN DIAG (US) 1996-08-21 EP claimed
EP-0462644-B1 Biologically active reagents prepared from carboxy-containing polymer, analytical element and methods of use JOHNSON & JOHNSON CLIN DIAG (US) 1995-10-18 EP claimed