SCHEMBL4646434

SCHEMBL4646434

O=C(O)c1cc(NCc2ccc(Br)s2)[nH]n1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 12/20 0.38
DAO P14920 2/20 0.36
KDM4C Q9H3R0 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL4623217 0.76 HCAR2 (0.58) HCAR2DAOKDM4C
SCHEMBL4645294 0.74 HCAR2 (0.38) HCAR2DAOMEN1KMT2APOLB
SCHEMBL4646927 0.73 KDM4C (0.52) HCAR2DAOKDM4CMEN1KMT2A
SCHEMBL11424096 0.69 FFAR1 (0.45) DAOMEN1KMT2APOLB
SCHEMBL9943767 0.67 DAO (0.44) DAOMEN1KMT2AMAPT
SCHEMBL27729021 0.66 FFAR1 (0.45) DAOMEN1KMT2AMAPT
SCHEMBL26627939 0.64 KMT2A (0.58) MEN1KMT2APOLBMAPT
SCHEMBL4358645 0.64 EGFR (0.45) KDM4CMEN1KMT2AMAPT
SCHEMBL27729107 0.63 RAB9A (0.38) MEN1KMT2APOLBMAPT
SCHEMBL4347704 0.63 EGFR (0.37) MEN1KMT2APOLBMAPT

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