SCHEMBL4648477

SCHEMBL4648477

O=C(O)c1cc(NC(c2ccsc2)c2ccsc2)[nH]n1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HCAR2 Q8TDS4 11/20 0.38
HCAR3 P49019 3/20 0.38
DAO P14920 2/20 0.37
CYTH3 O43739 1/20 0.35
BTK Q06187 1/20 0.35
EPN1 Q9Y6I3 1/20 0.35
ACMSD Q8TDX5 1/20 0.35
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL4648274 0.77 MEN1 (0.52) MEN1KMT2AHCAR2HCAR3DAO
SCHEMBL4648548 0.76 MEN1 (0.39) MEN1KMT2AHCAR2HCAR3DAO
SCHEMBL4646927 0.74 KDM4C (0.52) MEN1KMT2AHCAR2HCAR3DAO
SCHEMBL3516314 0.68 MEN1 (0.55) MEN1KMT2AHCAR2HCAR3DAO
SCHEMBL4648277 0.67 KMT2A (0.42) MEN1KMT2AHCAR2HCAR3DAO
SCHEMBL4648485 0.65 HCAR2 (0.61) MEN1KMT2AHCAR2HCAR3DAO
SCHEMBL4649871 0.65 HCAR3 (0.58) HCAR2HCAR3DAOCYTH3BTK
SCHEMBL4648610 0.64 HCAR2 (0.47) HCAR2HCAR3DAOCYTH3BTK
SCHEMBL13933304 0.63 HCAR2 (0.53) HCAR2HCAR3DAOCYTH3BTK
SCHEMBL5008226 0.62 CASP3 (0.45) MEN1KMT2AHCAR2DAOCYTH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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