SCHEMBL10704086

SCHEMBL10704086

CCCCC1C=CC(=O)C1CC(O)CCCCC(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DNTT P04053 1/20 0.44
▸ PTGER2 P43116 8/20 0.43
▸ TRPA1 O75762 2/20 0.42
▸ NR4A2 P43354 2/20 0.42
▸ PTGER3 P43115 3/20 0.42
▸ PTGER4 P35408 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ PPARG P37231 4/20 0.39
▸ PPARA Q07869 2/20 0.38
▸ PPARD Q03181 1/20 0.38
▸ DAGLA Q9Y4D2 1/20 0.37

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
SCHEMBL11866505 0.85 TRPA1 (0.48) DNTTPTGER2TRPA1NR4A2PTGER3
SCHEMBL11866497 0.85 TRPA1 (0.48) DNTTPTGER2TRPA1NR4A2PTGER3
SCHEMBL10624014 0.81 DNTT (0.48) DNTTPTGER2TRPA1NR4A2PTGER3
SCHEMBL2948238 0.76 PTGER4 (0.48) DNTTPTGER2TRPA1PTGER3PTGER4
SCHEMBL2948236 0.76 PTGER4 (0.48) DNTTPTGER2TRPA1PTGER3PTGER4
SCHEMBL11866489 0.75 DNTT (0.50) DNTTPTGER2TRPA1NR4A2PTGER3
SCHEMBL11866493 0.75 DNTT (0.50) DNTTPTGER2TRPA1NR4A2PTGER3
SCHEMBL11867713 0.75 TRPA1 (0.49) DNTTPTGER2TRPA1NR4A2PTGER3
SCHEMBL11867811 0.75 DNTT (0.42) DNTTPTGER2TRPA1NR4A2PTGER3
SCHEMBL11867800 0.75 DNTT (0.42) DNTTPTGER2TRPA1NR4A2PTGER3

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-0106576-B1 NOVEL 5-MEMBERED CYCLIC COMPOUNDS, PROCESS FOR THE PRODUCTION THEREOF, AND PHARMACEUTICAL USE THEREOF TEIJIN LIMITED (JP) 1988-03-09 — — EP disclosed
EP-0106576-A2 Novel 5-membered cyclic compounds, process for the production thereof, and pharmaceutical use thereof TEIJIN LIMITED (JP) 1984-04-25 — — EP disclosed
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