SCHEMBL6380733

SCHEMBL6380733

CCCCCCCCCc1cc(C(=O)O)n(F)n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.46
HCAR3 P49019 2/20 0.43
PPARA Q07869 2/20 0.42
RARB P10826 7/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
KAT8 Q9H7Z6 2/20 0.39
RARA P10276 2/20 0.39
RARG P13631 1/20 0.39
SCD O00767 1/20 0.38
GPR35 Q9HC97 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
MTOR P42345 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL20503261 0.83 KDM4E (0.45) HCAR2HCAR3PPARARARBCNR1
SCHEMBL17288712 0.81 KDM4E (0.46) HCAR2HCAR3PPARACNR1CNR2
SCHEMBL2934234 0.76 KDM4E (0.47) HCAR2HCAR3MEN1ALDH1A1MAPT
SCHEMBL9468599 0.76 KDM5A (0.43) HCAR2HCAR3PPARARARBCNR1
SCHEMBL4045930 0.71 GRN (0.33) ALDH1A1
SCHEMBL20503314 0.70 LMNA (0.44) PPARACNR2MEN1MAPTKMT2A
SCHEMBL1017 0.69 GRN (0.43) HCAR2HCAR3GPR35ALDH1A1MAPT
SCHEMBL27694050 0.69 POLB (0.48) PPARACNR1CNR2
SCHEMBL28251767 0.68 ALDH1A1 (0.41) HCAR2ALDH1A1
SCHEMBL11116628 0.67 RARB (0.49) HCAR2HCAR3PPARARARBRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551403-A1 5-SUBSTITUTED 2H-PYRAZONE-3-CARBOXYLIC ACID DERIVATIVES AS ANTILIPOLYTIC AGENTS FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS SUCH AS DYSLIPIDEMIA Arena Pharmaceuticals, Inc. (US) 2005-07-13 EP disclosed
WO-2004032928-A1 5-SUBSTITUTED 2H-PYRAZONE-3-CARBOXYLIC ACID DERIVATIVES AS ANTILIPOLYTIC AGENTS FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS SUCH AS DYSLIPIDEMIA ARENA PHARMACEUTICALS, INC. (US) 2004-04-22 WO disclosed