SCHEMBL888641

SCHEMBL888641

COCC(CC(C)C(C)C)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MME P08473 2/20 0.35
CA14 Q9ULX7 3/20 0.34
CA12 O43570 2/20 0.34
KDM4E B2RXH2 2/20 0.33
KMT2A Q03164 1/20 0.33
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
BIRC2 Q13490 1/20 0.30
MAPT P10636 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL888341 0.85 MEN1 (0.34) KDM4EKMT2AALDH1A1HSD17B10
SCHEMBL819943 0.83 MME (0.47) SMN1; SMN2CA1CA2MMECA14
SCHEMBL888390 0.83 CA1 (0.38) SMN1; SMN2CA1CA2MMECA14
SCHEMBL888423 0.81 CA1 (0.43) SMN1; SMN2CA1CA2MMECA14
SCHEMBL1504014 0.80 CA1 (0.46) SMN1; SMN2CA1CA2MMECA14
SCHEMBL819724 0.80
SCHEMBL888504 0.73 CA2 (0.56) CA1CA2TDP1BIRC2MAPT
SCHEMBL8497696 0.72 CA1 (0.41) SMN1; SMN2CA1CA2MMECA14
SCHEMBL2884173 0.72 PRKCA (0.36) SMN1; SMN2CA1CA2MMEKMT2A
SCHEMBL4939390 0.71 CA1 (0.39) SMN1; SMN2CA1CA2MMECA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed