SCHEMBL8494134

SCHEMBL8494134

O=C1NC(=O)C(CCC2CCCCC2)(C2CC2C(=O)O)N1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.35
GRM3 Q14832 1/20 0.35
ADAMTS5 Q9UNA0 12/20 0.33
NAAA Q02083 3/20 0.33
MMP2 P08253 3/20 0.32
ADAM17 P78536 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL8497344 0.87 GRM2 (0.33) GRM2GRM3ADAMTS5MMP2ADAM17
SCHEMBL8493137 0.85 ADAMTS5 (0.33) GRM2GRM3ADAMTS5MMP2ADAM17
SCHEMBL8494212 0.84 ADAMTS5 (0.33) ADAMTS5MMP2ADAM17
SCHEMBL8497318 0.83 ADAMTS5 (0.33) ADAMTS5MMP2ADAM17
SCHEMBL8524338 0.80 TDP1 (0.35) ADAMTS5MMP2TDP1
SCHEMBL8495085 0.80 ADAMTS5 (0.34) ADAMTS5MMP2ADAM17TDP1
SCHEMBL8497338 0.79 MMP2 (0.36) ADAMTS5NAAAMMP2TDP1
SCHEMBL8495204 0.78 MMP2 (0.38) NAAAMMP2TDP1
SCHEMBL8494209 0.76 ADAMTS5 (0.35) ADAMTS5MMP2ADAM17
SCHEMBL8491109 0.75 GRM2 (0.39) GRM2GRM3ADAMTS5

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 2 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