SCHEMBL9742213

SCHEMBL9742213

CCCCCC(/C=C(\O[SiH](C)C)C1C=C(SCC)C(=O)C1C(O)CCCCCC(=O)OC)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTGER2 P43116 6/20 0.34
▸ PPARG P37231 2/20 0.33
▸ PTGER4 P35408 2/20 0.32
▸ PTGER3 P43115 2/20 0.32
▸ PPARA Q07869 1/20 0.32

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
SCHEMBL9546097 0.93 PTGER2 (0.34) PTGER2PPARGPTGER4PTGER3PPARA
SCHEMBL9546442 0.84 PTGER2 (0.37) PTGER2PPARGPTGER4PTGER3PPARA
SCHEMBL9546166 0.79 PPARG (0.33) PTGER2PPARGPTGER4PTGER3PPARA
SCHEMBL9546204 0.77 PPARG (0.36) PTGER2PPARGPTGER4PTGER3PPARA
SCHEMBL9546383 0.77 PPARG (0.31) PPARGPPARA
SCHEMBL9546101 0.73 PPARG (0.33) PTGER2PPARGPTGER4PTGER3PPARA
SCHEMBL10619325 0.71 NFKB1 (0.37) PTGER2PPARGPTGER4PTGER3PPARA
SCHEMBL9546377 0.70 PTGER3 (0.33) PTGER2PPARGPTGER4PTGER3PPARA
SCHEMBL9546109 0.68 PPARG (0.30) PPARG
SCHEMBL9546318 0.66 TRPA1 (0.43) PTGER2PPARGPTGER4PTGER3PPARA

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
US-5116869-A Antitumor Agents, Bone Formation Accelerator TEIJIN LIMITED (JP) 1992-05-26 — — US disclosed
EP-0338796-A2 2-Substituted-2-cyclopentenones TEIJIN LIMITED (JP) 1989-10-25 — — EP disclosed
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