SCHEMBL888273

SCHEMBL888273

COCC(C(=O)OC)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.43
NPC1 O15118 1/20 0.41
EPHX2 P34913 6/20 0.41
ATM Q13315 1/20 0.41
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40

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
SCHEMBL888548 0.87 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ATSHREPHX2
SCHEMBL888450 0.85 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPC1EPHX2
SCHEMBL820119 0.84 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ATSHRNPC1
SCHEMBL4424458 0.83 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ANPC1EPHX2
SCHEMBL29201779 0.74 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ANPC1EPHX2
SCHEMBL8105673 0.74 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ANPC1EPHX2
SCHEMBL888633 0.73 LMNA (0.42) ALDH1A1MEN1KMT2ANPC1EPHX2
SCHEMBL15535092 0.73 DPP4 (0.51) ALDH1A1NPC1EPHX2ITGB1ITGA4
SCHEMBL15149731 0.73 DPP4 (0.51) ALDH1A1NPC1EPHX2ITGB1ITGA4
SCHEMBL1628767 0.73 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPC1EPHX2

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