SCHEMBL20814743

SCHEMBL20814743

CC1=C(C)C([Zr](C2C(C)=C(c3ccsc3)c3ccccc32)=[Si](C)C)C(C)=C1C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2E1 P05181 1/20 0.32
CYP2A6 P11509 1/20 0.32
CYP2B6 P20813 1/20 0.32
PTPRC P08575 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
SCHEMBL20814865 0.85
SCHEMBL20814740 0.82
SCHEMBL20814860 0.81 NAT1 (0.30)
SCHEMBL20814748 0.80 RAB9A (0.32)
SCHEMBL20814739 0.79 GSTP1 (0.32)
SCHEMBL20814805 0.78 CYP11B1 (0.37) CYP2E1CYP2A6CYP2B6
SCHEMBL20814993 0.78 CYP2E1 (0.30) CYP2E1CYP2A6CYP2B6
SCHEMBL20814769 0.75
SCHEMBL20814937 0.75 CDC25A (0.32)
SCHEMBL20814790 0.75 KDM4E (0.32)

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
EP-2935297-B1 BRIDGED METALLOCENE COMPOUNDS, CATALYST SYSTEMS AND PROCESSES FOR POLYMERIZATION THEREWITH EXXONMOBIL CHEMICAL PATENTS INC (US) 2019-03-20 EP claimed