SCHEMBL7361675

SCHEMBL7361675

Cc1ccc(C(CCC(=O)O)C2CC2C(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
KMT2A Q03164 3/20 0.39
FFAR1 O14842 4/20 0.38
HSD11B1 P28845 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
PTGFR P43088 1/20 0.36
GRIK2 Q13002 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
SLC6A9 P48067 1/20 0.35
RAB9A P51151 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
SCHEMBL7401588 0.87 NAALAD2 (0.42) CA2KMT2AFFAR1ALDH1A1CYP1A2
SCHEMBL7364668 0.85 ANPEP (0.37) KMT2AFFAR1ALDH1A1CYP1A2
SCHEMBL7399249 0.85 GABBR2 (0.39) KMT2AFFAR1HSD11B1CYP1A2SLC6A9
SCHEMBL7396691 0.85 TSHR (0.36) KMT2AFFAR1ALDH1A1CYP1A2
SCHEMBL7366777 0.85 HSD11B1 (0.42) KMT2AHSD11B1PTGFRALDH1A1CYP1A2
SCHEMBL7400114 0.85 SLC6A9 (0.41) FFAR1PTGFRGRIK2ALDH1A1CYP1A2
SCHEMBL7367347 0.79 GRM2 (0.37) KMT2AALDH1A1CYP1A2
SCHEMBL7367032 0.79 ALDH1A1 (0.36) FFAR1PTGFRALDH1A1CYP1A2RAB9A
SCHEMBL7364859 0.77 ANPEP (0.43) CA1CA2GRIK2ALDH1A1CYP1A2
SCHEMBL7365727 0.77 SLC6A9 (0.41) FFAR1L3MBTL1ALDH1A1CYP1A2SLC6A9

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