SCHEMBL7048060

SCHEMBL7048060

CCOC(=O)C(CC)(C(=O)O)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
THRB P10828 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CHRM2 P08172 5/20 0.37
CHRM1 P11229 5/20 0.37
CHRM4 P08173 4/20 0.37
CHRM3 P20309 4/20 0.37
CYP2C19 P33261 2/20 0.37
KCNH2 Q12809 2/20 0.37
SLC6A3 Q01959 2/20 0.37
MAPT P10636 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
PKM P14618 1/20 0.37
NFKB1 P19838 1/20 0.37
THPO P40225 1/20 0.37
ABCB11 O95342 1/20 0.37

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
SCHEMBL16732287 0.93 ALDH1A1 (0.40) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL16732047 0.91 ALDH1A1 (0.38) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL27473169 0.88 THRB (0.40) ALDH1A1THRBATML3MBTL1CYP2C19
SCHEMBL11023958 0.87 ALDH1A1 (0.36) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL13269015 0.86 ALDH1A1 (0.34) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL13269467 0.85 CHRM2 (0.33) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL13269031 0.85 CHRM2 (0.33) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL13268892 0.84 ALDH1A1 (0.32) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL8735978 0.83 KEAP1 (0.37) ALDH1A1CHRM2CHRM1CHRM4CHRM3
SCHEMBL13269408 0.83 ALDH1A1 (0.32) ALDH1A1THRBATML3MBTL1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912617-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SPA (IT) 2003-04-16 EP claimed
US-6313238-B1 POLYMERIZATION OF ALPHA-OLEFINS IN PRESENCE OF POLYMERIZATION CATALYST SYSTEM COMPRISING REACTION PRODUCT OF TITANIUM COMPOUND, AND ELECTRON DONOR COMPRISING MALONIC ESTER SUPPORTED ON MAGNESIUM HALIDE, ALKYLALUMINUM COMPOUND BASELL TECHNOLOGY COMPANY BV (NL) 2001-11-06 US claimed
US-6048818-A Components and catalysts for the polymerization of olefins MONTELL TECHNOLOGY COMPANY BV (NL) 2000-04-11 US claimed
EP-0912617-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 1999-05-06 EP claimed
WO-1998056833-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-12-17 WO claimed
EP-0912617-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SPA (IT) 2003-04-16 EP disclosed
US-6313238-B1 POLYMERIZATION OF ALPHA-OLEFINS IN PRESENCE OF POLYMERIZATION CATALYST SYSTEM COMPRISING REACTION PRODUCT OF TITANIUM COMPOUND, AND ELECTRON DONOR COMPRISING MALONIC ESTER SUPPORTED ON MAGNESIUM HALIDE, ALKYLALUMINUM COMPOUND BASELL TECHNOLOGY COMPANY BV (NL) 2001-11-06 US disclosed
US-6048818-A Components and catalysts for the polymerization of olefins MONTELL TECHNOLOGY COMPANY BV (NL) 2000-04-11 US disclosed
EP-0912617-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 1999-05-06 EP disclosed
WO-1998056833-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-12-17 WO disclosed