SCHEMBL7366774

SCHEMBL7366774

O=C(O)C(CCc1ccc(F)cc1)C1CC1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.48
GRM3 Q14832 1/20 0.48
CPA1 P15085 1/20 0.47
TAAR1 Q96RJ0 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.41
PTGER1 P34995 1/20 0.40
PTGFR P43088 1/20 0.40
AGTR2 P50052 3/20 0.39
FFAR4 Q5NUL3 3/20 0.38
HTT P42858 1/20 0.38
TLR2 O60603 1/20 0.38
TLR1 Q15399 1/20 0.38
FFAR1 O14842 1/20 0.37

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
SCHEMBL7401586 0.87 SLC7A5 (0.38) GRM2GRM3
SCHEMBL7361669 0.86 SMN1; SMN2 (0.42) GRM2GRM3SMN1; SMN2PTGFRFFAR1
SCHEMBL7364664 0.86 RARB (0.38) GRM2GRM3
SCHEMBL7396689 0.86 KMT2A (0.37) GRM2GRM3FFAR4FFAR1
SCHEMBL7399248 0.86 HSD17B10 (0.45) GRM2GRM3FFAR4
SCHEMBL7367779 0.84 CPA1 (0.37) GRM2GRM3CPA1FFAR4HTT
SCHEMBL7363860 0.83 PTGER1 (0.42) GRM2GRM3TAAR1PTGER1PTGFR
SCHEMBL7360786 0.82 LDHA (0.47) SMN1; SMN2PTGFRFFAR1
SCHEMBL7360104 0.79 CYP1A2 (0.46)
SCHEMBL7363028 0.78 SLC6A2 (0.41) GRM2TAAR1SMN1; SMN2

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