SCHEMBL5309702

SCHEMBL5309702

CCCON=C(COc1cc(C(=O)O)c2ccccc2c1)c1cc(-c2ccc(F)cc2)no1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.43
▸ PTPN1 P18031 2/20 0.39
▸ PPARG P37231 3/20 0.39
▸ PPARA Q07869 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ DHODH Q02127 5/20 0.36
▸ CCKAR P32238 1/20 0.36

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
SCHEMBL5309698 1.00 PDE10A (0.43) PDE10APTPN1PPARGPPARAKDM4E
SCHEMBL5312222 0.92 PLA2G2A (0.42) PDE10APTPN1PPARGPPARAKDM4E
SCHEMBL5312224 0.92 PLA2G2A (0.42) PDE10APTPN1PPARGPPARAKDM4E
SCHEMBL5312855 0.91 PDE10A (0.41) PDE10APTPN1KDM4ERAB9ASMN1; SMN2
SCHEMBL5312854 0.91 PDE10A (0.41) PDE10APTPN1KDM4ERAB9ASMN1; SMN2
SCHEMBL5316174 0.91 PPARG (0.40) PDE10APTPN1PPARGPPARAKDM4E
SCHEMBL5310846 0.88 PDE10A (0.43) PDE10APTPN1PPARGPPARAKDM4E
SCHEMBL14530972 0.88 PDE10A (0.43) PDE10APTPN1PPARGPPARAKDM4E
SCHEMBL5316013 0.87 PTPN11 (0.42) PDE10APTPN1PPARGPPARAKDM4E
SCHEMBL5316012 0.87 PTPN11 (0.42) PDE10APTPN1PPARGPPARAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007058504-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES, LTD. (KR) 2007-05-24 — — WO disclosed
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