SCHEMBL888448

SCHEMBL888448

CCOC12CC3CC(CC(C3)C1CCC(=O)OC)C2

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.40
CA12 O43570 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
LMNA P02545 1/20 0.35
EPHX1 P07099 3/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 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
SCHEMBL888631 0.89 EPHX2 (0.42) EPHX2LMNAALDH1A1
SCHEMBL888270 0.87 EPHX2 (0.43) EPHX2CA12CA2CA7CA9
SCHEMBL819515 0.86 LMNA (0.33) EPHX2LMNAALDH1A1TSHR
SCHEMBL888545 0.81 EPHX2 (0.42) EPHX2LMNAALDH1A1
SCHEMBL888522 0.78 EPHX2 (0.39) EPHX2LMNAALDH1A1
SCHEMBL820117 0.74 EPHX2 (0.32) EPHX2CA12CA2CA7CA9
SCHEMBL819750 0.71 EPHX2 (0.34) EPHX2
SCHEMBL5607981 0.70 LMNA (0.36) EPHX2LMNAALDH1A1TSHR
SCHEMBL888451 0.69 ALDH1A1 (0.40) LMNAALDH1A1TSHR
SCHEMBL28851795 0.68 ALDH1A1 (0.33) EPHX2LMNAALDH1A1TSHR

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-20130190464-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-25 US disclosed
US-20130109789-A1 OLEFIN POLYMERIZATION CATALYST, PROCESS FOR PRODUCING OLEFIN POLYMER, POLYPROPYLENE RESIN COMPOSITION AND ARTICLE COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-02 US disclosed
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed