SCHEMBL9546159

SCHEMBL9546159

CCCCCCC=CC1C=C(SC)C(=O)C1=CCCCCCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 6/20 0.48
▸ PPARD Q03181 6/20 0.48
▸ PPARA Q07869 6/20 0.48
▸ F7 P08709 6/20 0.48
▸ F3 P13726 6/20 0.48
▸ ALDH1A1 P00352 4/20 0.48
▸ FABP4 P15090 3/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ PTGS1 P23219 3/20 0.48
▸ FFAR1 O14842 3/20 0.48
▸ DUSP3 P51452 2/20 0.48
▸ PTPN7 P35236 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ CYP19A1 P11511 2/20 0.48
▸ ALOX15 P16050 2/20 0.48
▸ NR4A2 P43354 2/20 0.48
▸ SIRT6 Q8N6T7 2/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ FABP3 P05413 1/20 0.48

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
SCHEMBL9546156 1.00 PPARG (0.48) PPARGPPARDPPARAF7F3
SCHEMBL9546183 0.88 EPHX2 (0.42) ALDH1A1OXER1
SCHEMBL10606550 0.84 PPARG (0.50) PPARGPPARDPPARAF7F3
SCHEMBL10608208 0.84 PPARG (0.50) PPARGPPARDPPARAF7F3
SCHEMBL10622161 0.77 PPARG (0.55) PPARGPPARDPPARAF7F3
SCHEMBL10622158 0.77 PPARG (0.55) PPARGPPARDPPARAF7F3
SCHEMBL24854676 0.71 PPARG (0.51) PPARGPPARDPPARAF7F3
Oleic Acid SCHEMBL31213146 0.70 PPARG (0.89) PPARGPPARDPPARAF7F3
Oleic Acid SCHEMBL9931678 0.70 PPARG (0.96) PPARGPPARDPPARAF7F3
Oleic Acid SCHEMBL15296 0.70 PPARG (0.96) PPARGPPARDPPARAF7F3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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