SCHEMBL7364664

SCHEMBL7364664

O=C(O)c1ccc(CCC(C(=O)O)C2CC2C(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.38
FOLH1 Q04609 4/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
GRM8 O00222 1/20 0.37
GRM6 O15303 1/20 0.37
LMNA P02545 1/20 0.37
APEX1 P27695 1/20 0.37
GRM5 P41594 1/20 0.37
PMP22 Q01453 1/20 0.37
GRM1 Q13255 1/20 0.37
GRM2 Q14416 1/20 0.37
GRM3 Q14832 1/20 0.37
GRM4 Q14833 1/20 0.37
KDM4E B2RXH2 1/20 0.37
SLC1A2 P43004 1/20 0.37
RARA P10276 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
SCHEMBL7401586 0.87 SLC7A5 (0.38) ALDH1A1MEN1KMT2ACYP2C9CYP2C19
SCHEMBL7396689 0.86 KMT2A (0.37) ALDH1A1MEN1KMT2ACYP2C9CYP2C19
SCHEMBL7366774 0.86 GRM2 (0.48) GRM2GRM3
SCHEMBL7399248 0.86 HSD17B10 (0.45) ALDH1A1MEN1KMT2ACYP2C9CYP2C19
SCHEMBL7361669 0.86 SMN1; SMN2 (0.42) ALDH1A1MEN1KMT2ACYP2C9CYP2C19
SCHEMBL7364857 0.84 GRM2 (0.52) FOLH1CYP2C9GRM2GRM3
SCHEMBL7360786 0.82 LDHA (0.47) ALDH1A1MEN1KMT2ACYP2C19KDM4E
SCHEMBL7360104 0.79 CYP1A2 (0.46) SLC1A2
SCHEMBL7367342 0.78 GRM2 (0.51) MEN1KMT2ACYP2C9CYP2C19GRM8
SCHEMBL7398125 0.77 GRM2 (0.48) ALDH1A1KMT2AGRM2GRM3MAPT

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