SCHEMBL7783891

SCHEMBL7783891

CCOC(=O)C(C(=O)OCC)(C1CCCCC1)C1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
THRB P10828 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CHRM2 P08172 4/20 0.39
CHRM1 P11229 4/20 0.39
SLC6A3 Q01959 2/20 0.39
KCNH2 Q12809 2/20 0.39
POLB P06746 1/20 0.38
CHRM4 P08173 3/20 0.37
CHRM3 P20309 3/20 0.37
CYP2C19 P33261 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

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
SCHEMBL28867351 0.98 ALDH1A1 (0.40) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL19071938 0.82 ALDH1A1 (0.41) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL16732122 0.82 ALDH1A1 (0.41) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL28647855 0.82 CHRM2 (0.46) ALDH1A1L3MBTL1CHRM2CHRM1SLC6A3
SCHEMBL16732287 0.81 ALDH1A1 (0.40) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL7439983 0.81 ALDH1A1 (0.40) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL9930514 0.81 ALDH1A1 (0.41) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL1785395 0.81 ALDH1A1 (0.41) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL10028034 0.80 ALDH1A1 (0.39) ALDH1A1THRBATML3MBTL1CHRM2
SCHEMBL11467470 0.80 ALDH1A1 (0.39) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1141044-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER Basell Technology Company B.V. (NL) 2001-10-10 EP disclosed
WO-2001036496-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER BASELL TECHNOLOGY COMPANY B.V. (NL) 2001-05-25 WO disclosed