SCHEMBL13634341

SCHEMBL13634341

CCOCCN(C)c1nc(C(=O)O)co1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 6/20 0.33
PPARG P37231 2/20 0.32
PPARA Q07869 1/20 0.32
THRA P10827 1/20 0.32
RARA P10276 1/20 0.30
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30
CES1 P23141 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HCAR3 P49019 1/20 0.30

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
SCHEMBL15888647 0.86 NLRP3 (0.41) KDM4E
SCHEMBL2771127 0.86 CFTR (0.37) HCAR2PPARG
SCHEMBL13162339 0.82 PPARG (0.34) PPARGPPARAKDM4E
SCHEMBL18739885 0.79 PLA2G4A (0.39) HCAR2CES1HCAR3
SCHEMBL13634371 0.77
SCHEMBL13162319 0.77 CES1 (0.33) CES1
SCHEMBL2077461 0.76 CYP1A2 (0.41) KDM4E
SCHEMBL15888557 0.73 CYP1A2 (0.38) PPARGPPARAKDM4E
SCHEMBL13634202 0.72 MEN1 (0.38) HCAR2RARARARBRARGKDM4E
SCHEMBL3436754 0.71 HPGD (0.40) KDM4E

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-2206707-B1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-07-23 EP disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed