SCHEMBL7365439

SCHEMBL7365439

O=C(O)C(CCc1ccccc1Oc1ccccc1)C1CC1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.43
PPARA Q07869 1/20 0.41
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 3/20 0.40
SLC6A3 Q01959 2/20 0.40
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 6/20 0.39
SLC1A5 Q15758 2/20 0.38
CYP2D6 P10635 1/20 0.38
MME P08473 1/20 0.37
ACE P12821 1/20 0.37
CPA1 P15085 1/20 0.37
ACE2 Q9BYF1 1/20 0.37
P2RY10 O00398 1/20 0.37
RIPK1 Q13546 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL7368285 0.86 PTGFR (0.45)
SCHEMBL7367030 0.80 PTGER1 (0.42) PPARAFFAR1ALDH1A1
SCHEMBL7363860 0.80 PTGER1 (0.42) PPARAALDH1A1
SCHEMBL7363028 0.80 SLC6A2 (0.41) PPARASLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL7369261 0.79 ALDH1A1 (0.41) KDM4EALDH1A1
SCHEMBL7368270 0.78 GRM2 (0.52) ALDH1A1
SCHEMBL7366774 0.77 GRM2 (0.48) FFAR1FFAR4CPA1
SCHEMBL7360104 0.75 CYP1A2 (0.46)
SCHEMBL7362960 0.75 GRM2 (0.55) ALDH1A1
SCHEMBL7362412 0.74 HSD17B10 (0.48) KDM4EALDH1A1

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