SCHEMBL21799268

SCHEMBL21799268

CCC[Si](NCC)(NCC)C1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.31
NAAA Q02083 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
SCHEMBL21799269 0.98
SCHEMBL21799278 0.83 ALDH1A1 (0.31) EPHX1ALDH1A1
SCHEMBL21799280 0.80
SCHEMBL235077 0.73 ALDH1A1 (0.33) EPHX1ALDH1A1CYP1A2
SCHEMBL235839 0.73 ALDH1A1 (0.33) EPHX1ALDH1A1CYP1A2
SCHEMBL234856 0.73 ALDH1A1 (0.33) EPHX1ALDH1A1CYP1A2
SCHEMBL231324 0.71 ALDH1A1 (0.32) EPHX1ALDH1A1CYP1A2
SCHEMBL3894331 0.70 CYP1A2 (0.37) EPHX1KDM4EALDH1A1CYP1A2NAAA
SCHEMBL235111 0.70
SCHEMBL15915092 0.70 CYP1A2 (0.37) EPHX1KDM4EALDH1A1CYP1A2NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200140577-A1 CATALYST FOR POLYMERIZATION OF AN OLEFIN, METHOD FOR PRODUCING POLYMER OF OLEFIN AND PROPYLENE-alpha-OLEFIN COPOLYMER TOHO TITANIUM CO., LTD. (JP) 2020-05-07 US disclosed
EP-3623393-A1 CATALYST FOR OLEFIN POLYMERIZATION, METHOD FOR PRODUCING OLEFIN POLYMER, AND PROPYLENE/ -OLEFIN COPOLYMER Toho Titanium Co., Ltd. (JP) 2020-03-18 EP disclosed