SCHEMBL7337692

SCHEMBL7337692

O=C(CCC12CC3CC(CC(C3)C1)C2)CCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.50
GRIN2D O15399 4/20 0.50
GRIN3B O60391 4/20 0.50
GRIN1 Q05586 4/20 0.50
GRIN2A Q12879 4/20 0.50
GRIN2B Q13224 4/20 0.50
GRIN2C Q14957 4/20 0.50
GRIN3A Q8TCU5 4/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 5/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.42
BPTF Q12830 1/20 0.42
CCR6 P51684 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL23791655 0.89 EPHX2 (0.46) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3763631 0.84 EPHX2 (0.48) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1323193 0.84 EPHX2 (0.48) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6858927 0.84 EPHX2 (0.48) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11554971 0.82 EPHX2 (0.41) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL660423 0.82 ALDH1A1 (0.53) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13780945 0.82 MEN1 (0.49) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2409327 0.79 EPHX2 (0.44) EPHX2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4779105 0.77 MEN1 (0.50) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL14277228 0.77 MEN1 (0.50) EPHX2GRIN2DGRIN3BGRIN1GRIN2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0771196-B1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS LILLY CO ELI (US) 1999-12-08 EP disclosed
US-5717109-A CARBOXYCYCLOPROPYL GLYCINE DERIVATIVES; USEFUL FOR TREATMENT OF ACUTE OR CHRONIC NEURODEGENERATIVE CONDITIONS, AND AS ANTIPSYCHOTIC, ANTICONVULSANT, ANALGESIC, ANXIOLYTIC, ANTIDEPRESSANT AND ANTI-EMETIC AGENTS ELI LILLY AND COMPANY (US) 1998-02-10 US disclosed
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