SCHEMBL4381959

SCHEMBL4381959

CC(C)(C)COC(=O)C(F)(F)C(F)(F)C(=O)OCC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL15853320 0.85 HTT (0.34) HTTCYP2C19KMT2ALMNAHSD17B10
SCHEMBL18293615 0.85 HTT (0.34) HTTCYP2C19KMT2ALMNAHSD17B10
SCHEMBL19472473 0.79 POLB (0.33) HTTCYP2C19KMT2AALDH1A1
SCHEMBL1785142 0.79 CYP2C19 (0.36) CYP2C19KMT2ALMNAHSD17B10
SCHEMBL733594 0.79 PRKCA (0.43) CYP2C19KMT2ALMNAHSD17B10ALDH1A1
SCHEMBL7943716 0.79 DGAT1 (0.37) CYP2C19KMT2ALMNAHSD17B10
SCHEMBL23293628 0.77 ALDH1A1 (0.36) CYP2C19KMT2ALMNAHSD17B10ALDH1A1
Hydrogen Peroxide SCHEMBL28451976 0.77 PRKCA (0.42) CYP2C19KMT2ALMNAHSD17B10ALDH1A1
SCHEMBL3414597 0.76
SCHEMBL5611254 0.75 CYP2C19 (0.39) CYP2C19KMT2ALMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114716591-B Catalyst component for propylene polymerization, preparation method and application thereof 任丘市利和科技发展有限公司 2024-05-28 CN disclosed
EP-1539838-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SRL (IT) 2009-11-25 EP disclosed
US-7202314-B2 Components and catalysts for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2007-04-10 US disclosed
US-20060105906-A1 Components and catalysts for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2006-05-18 US disclosed
EP-1539838-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.P.A. (IT) 2005-06-15 EP disclosed
WO-2004024785-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2004-03-25 WO disclosed