SCHEMBL2028007

SCHEMBL2028007

CCCCC(Sc1ccccc1)C(=O)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 15/20 0.54
▸ PPARA Q07869 14/20 0.54
▸ ALOX5 P09917 13/20 0.54
▸ PTGES O14684 10/20 0.51
▸ LMNA P02545 1/20 0.48
▸ PAX8 Q06710 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL5080497 0.84 PPARG (0.72) PPARGPPARAALOX5PTGESHSD17B10
SCHEMBL5081085 0.80 PPARG (0.66) PPARGPPARAALOX5PTGESHSD17B10
SCHEMBL7317662 0.79 MMP9 (0.55) PPARGPPARAALOX5PTGESLMNA
SCHEMBL9099026 0.78 PPARG (0.64) PPARGPPARAALOX5PTGESHSD17B10
SCHEMBL22612343 0.78 PPARG (0.64) PPARGPPARAALOX5PTGESHSD17B10
SCHEMBL8356987 0.78 PPARG (0.64) PPARGPPARAALOX5PTGESHSD17B10
SCHEMBL9099036 0.78 PPARG (0.64) PPARGPPARAALOX5PTGESHSD17B10
SCHEMBL2024875 0.78 ADAM17 (0.43) LMNAPAX8HSD17B10SMN1; SMN2PKM
SCHEMBL2351097 0.74 PPARG (0.58) PPARGPPARAALOX5PTGESPKM
SCHEMBL8856146 0.74 PPARG (0.52) PPARGPPARAALOX5PTGESLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152480-A1 Catalysts for Polymerizing Olefins and Method Thereof BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2011-06-23 — — US disclosed
US-20110152480-A1 Catalysts for Polymerizing Olefins and Method Thereof BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2011-06-23 — — US disclosed
US-20110152480-A1 Catalysts for Polymerizing Olefins and Method Thereof BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2011-06-23 — — US disclosed
EP-2331589-A1 CATALYSTS FOR POLYMERIZING OLEFINS AND METHOD THEREOF Basell Poliolefine Italia S.R.L. (IT) 2011-06-15 — — EP disclosed
WO-2010026184-A1 CATALYSTS FOR POLYMERIZING OLEFINS AND METHOD THEREOF BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2010-03-11 — — WO disclosed
WO-2010026184-A1 CATALYSTS FOR POLYMERIZING OLEFINS AND METHOD THEREOF BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2010-03-11 — — WO disclosed
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