SCHEMBL7368286

SCHEMBL7368286

COc1ccccc1C(CCC(=O)O)C1CC1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
POLB P06746 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
PTGFR P43088 1/20 0.39
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA9 Q16790 3/20 0.38
CA12 O43570 2/20 0.38
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RORC P51449 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CA7 P43166 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
SCHEMBL7369266 0.90 KDM4E (0.38) LMNAPOLBHTTNPSR1L3MBTL1
SCHEMBL7365442 0.88 FFAR4 (0.40) CYP1A2ALDH1A1FFAR1
SCHEMBL7362413 0.85 ADRA1A (0.42) LMNAPOLBNPSR1CA1CA2
SCHEMBL7367032 0.84 ALDH1A1 (0.36) POLBPTGFRCYP1A2CYP2D6TSHR
SCHEMBL7363863 0.82 CNR2 (0.36) L3MBTL1PTGFRCYP1A2CYP2D6TSHR
SCHEMBL7363033 0.82 ALDH1A1 (0.36) POLBCYP1A2CYP2D6TSHRALDH1A1
SCHEMBL7368272 0.80 CYP2C19 (0.41) HTTSMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL7360789 0.79 PDE4B (0.41) HTTNPSR1L3MBTL1PTGFRALDH1A1
SCHEMBL7362964 0.77 FFAR1 (0.45) LMNAPOLBL3MBTL1PTGFRRORC
SCHEMBL7367783 0.74 HTT (0.37) HTTMAPK1FFAR1

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