SCHEMBL4649871

SCHEMBL4649871

CCCC(C)Nc1cc(C(=O)O)n[nH]1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 5/20 0.58
HCAR2 Q8TDS4 14/20 0.49
DAO P14920 1/20 0.44
CYTH3 O43739 1/20 0.37
BTK Q06187 1/20 0.37
EPN1 Q9Y6I3 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
SCHEMBL5279554 0.72 HCAR2 (0.49) HCAR3HCAR2DAO
SCHEMBL13933304 0.69 HCAR2 (0.53) HCAR3HCAR2DAOCYTH3BTK
SCHEMBL4648610 0.67 HCAR2 (0.47) HCAR3HCAR2DAOCYTH3BTK
SCHEMBL3999370 0.66 HCAR2 (1.00) HCAR3HCAR2DAO
SCHEMBL1149439 0.66 HCAR2 (0.68) HCAR3HCAR2DAO
SCHEMBL4648274 0.66 MEN1 (0.52) HCAR3HCAR2DAOCYTH3BTK
SCHEMBL165390 0.65
SCHEMBL3954952 0.65 HCAR2 (1.00) HCAR3HCAR2DAO
SCHEMBL1739326 0.65 HCAR2 (1.00) HCAR3HCAR2DAOCYTH3BTK
SCHEMBL4648548 0.65 MEN1 (0.39) HCAR3HCAR2DAOCYTH3BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1156817-B1 CONTROLLING PROTEIN LEVELS IN EUCARYOTIC ORGANISMS WELLSTAT BIOCATALYSIS LLC (US) 2008-08-27 EP claimed
EP-1899304-A1 5-AMINO-1H-PYRAZOLE-3-CARBOXYLIC ACID DERIVATIVES AS AGONISTS FOR THE G-PROTEIN COUPLED RECEPTOR (GPCR) RUP38 FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF Arena Pharmaceuticals, Inc. (US) 2008-03-19 EP claimed
WO-2006127595-A1 5-AMINOPYRAZOLE CARBOXYLIC ACID DERIVATIVES AND METHODS OF TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF ARENA PHARMACEUTICALS, INC. (US) 2006-11-30 WO claimed
EP-1899304-A1 5-AMINO-1H-PYRAZOLE-3-CARBOXYLIC ACID DERIVATIVES AS AGONISTS FOR THE G-PROTEIN COUPLED RECEPTOR (GPCR) RUP38 FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF Arena Pharmaceuticals, Inc. (US) 2008-03-19 EP disclosed
WO-2006127595-A1 5-AMINOPYRAZOLE CARBOXYLIC ACID DERIVATIVES AND METHODS OF TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF ARENA PHARMACEUTICALS, INC. (US) 2006-11-30 WO disclosed