SCHEMBL7363860

SCHEMBL7363860

O=C(O)C(CCc1ccccc1F)C1CC1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.42
PTGFR P43088 1/20 0.42
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
KDM1A O60341 2/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.36
GRM2 Q14416 2/20 0.35
GRM3 Q14832 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 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
SCHEMBL7367779 0.84 CPA1 (0.37) MAOBGRM2GRM3
SCHEMBL7363028 0.84 SLC6A2 (0.41) PPARGPPARATAAR1KDM1AALDH1A1
SCHEMBL7367030 0.84 PTGER1 (0.42) PTGER1PTGFRPPARGPPARATAAR1
SCHEMBL7366774 0.83 GRM2 (0.48) PTGER1PTGFRTAAR1GRM2GRM3
SCHEMBL7368270 0.82 GRM2 (0.52) ALDH1A1CYP1A2GRM2GRM3CYP2C19
SCHEMBL7368285 0.81 PTGFR (0.45) PTGFRTAAR1KDM1AMAOAMAOB
SCHEMBL7365439 0.80 HRH1 (0.43) PPARAALDH1A1
SCHEMBL7360104 0.76 CYP1A2 (0.46) CYP1A2
SCHEMBL7401586 0.76 SLC7A5 (0.38) ALDH1A1CYP1A2GRM2GRM3CYP2C9
SCHEMBL7361069 0.76 CYP1A2 (0.45) TAAR1ALDH1A1CYP1A2GRM2GRM3

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-0771196-A4 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS LILLY CO ELI (US) 1997-09-03 EP disclosed
EP-0771196-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-05-07 EP disclosed
WO-1996007405-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-03-14 WO disclosed