SCHEMBL9546101

SCHEMBL9546101

CCCCCC(/C=C(\O[SiH](C)C)C1C=C(SC)C(=O)/C1=C\CCCCCC(=O)OC)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.33
▸ PPARA Q07869 1/20 0.32
▸ TYR P14679 1/20 0.31
▸ PTGER2 P43116 3/20 0.31
▸ PRKCA P17252 2/20 0.31
▸ PTGER4 P35408 2/20 0.31
▸ PTGER3 P43115 2/20 0.31
▸ ALOX5 P09917 1/20 0.30

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
SCHEMBL9546166 0.93 PPARG (0.33) PPARGPPARAPTGER2PTGER4PTGER3
SCHEMBL10619325 0.84 NFKB1 (0.37) PPARGPPARATYRPTGER2PRKCA
SCHEMBL9546097 0.79 PTGER2 (0.34) PPARGPPARAPTGER2PTGER4PTGER3
SCHEMBL9546110 0.76 — —
SCHEMBL9742213 0.73 PTGER2 (0.34) PPARGPPARAPTGER2PTGER4PTGER3
SCHEMBL9546356 0.73 PTGER3 (0.43) PPARGPPARATYRPTGER2PRKCA
SCHEMBL9546354 0.73 PTGER3 (0.43) PPARGPPARATYRPTGER2PRKCA
SCHEMBL9546442 0.72 PTGER2 (0.37) PPARGPPARAPTGER2PTGER4PTGER3
SCHEMBL9546184 0.72 EPHX2 (0.42) TYRPRKCAALOX5
SCHEMBL9546183 0.72 EPHX2 (0.42) TYRPRKCAALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5216183-A Antitumor, anticarcinogenic agents; bone formation accelerators TEIJIN LIMITED (JP) 1993-06-01 — — US disclosed
EP-0338796-B1 2-SUBSTITUTED-2-CYCLOPENTENONES TEIJIN LIMITED (JP) 1993-03-10 — — EP disclosed
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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