SCHEMBL8495204

SCHEMBL8495204

CCCCCCCCC1(C2CC2C(=O)O)NC(=O)NC1=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.38
MMP9 P14780 5/20 0.38
MMP3 P08254 2/20 0.38
MMP8 P22894 3/20 0.37
MMP13 P45452 3/20 0.37
NAAA Q02083 3/20 0.35
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
TRPV1 Q8NER1 3/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL8497338 0.99 MMP2 (0.36) MMP2MMP9MMP3MMP8MMP13
SCHEMBL8524338 0.95 TDP1 (0.35) MMP2TDP1
SCHEMBL8490968 0.83 MMP9 (0.34) MMP2MMP9MMP3MMP8MMP13
SCHEMBL8494209 0.80 ADAMTS5 (0.35) MMP2MMP9MMP3MMP8MMP13
SCHEMBL8496566 0.79 GRM2 (0.41) MMP2MMP3MMP13ALDH1A1
SCHEMBL8494134 0.78 GRM2 (0.35) MMP2NAAATDP1
SCHEMBL8491375 0.75 ADAMTS5 (0.40) MMP2MMP3MMP13
SCHEMBL8494212 0.74 ADAMTS5 (0.33) MMP2
SCHEMBL8493137 0.73 ADAMTS5 (0.33) MMP2MMP9MMP3MMP8MMP13
SCHEMBL8495190 0.73 ADAMTS5 (0.37) MMP2MMP9MMP3MMP8MMP13

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