SCHEMBL5992133

SCHEMBL5992133

CCCC(CCOS(C)(=O)=O)Oc1ccc(CC)cc1C(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 9/20 0.60
▸ PPARD Q03181 9/20 0.60
▸ PPARA Q07869 7/20 0.52
▸ TP53 P04637 1/20 0.38
▸ ABCB1 P08183 1/20 0.36
▸ CCNB2 O95067 1/20 0.35
▸ CCNE2 O96020 1/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ CCNB1 P14635 1/20 0.35
▸ CCNE1 P24864 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CCNB3 Q8WWL7 1/20 0.35
▸ METAP2 P50579 1/20 0.35
▸ PTGS2 P35354 2/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.34
▸ PTGS1 P23219 1/20 0.34

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
SCHEMBL5992887 0.88 PPARG (0.63) PPARGPPARDPPARATP53CCNB2
SCHEMBL5989827 0.88 PPARG (0.63) PPARGPPARDPPARATP53CCNB2
SCHEMBL5989831 0.88 PPARG (0.63) PPARGPPARDPPARATP53CCNB2
SCHEMBL5991546 0.85 PPARG (0.61) PPARGPPARDPPARATP53ABCB1
SCHEMBL5997111 0.81 PPARG (0.55) PPARGPPARDPPARATP53ABCB1
SCHEMBL6054804 0.81 PPARG (0.60) PPARGPPARDPPARATP53ABCB1
SCHEMBL6054774 0.80 PPARG (0.59) PPARGPPARDPPARATP53PTGDR2
SCHEMBL5989470 0.78 PPARG (0.55) PPARGPPARDPPARATP53ABCB1
SCHEMBL5991032 0.78 PPARD (0.77) PPARGPPARDPPARAPTGDR2
SCHEMBL5990505 0.76 PPARG (0.49) PPARGPPARDPPARATP53ABCB1

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
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 — — US disclosed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 — — EP disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 — — WO disclosed
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