SCHEMBL7142364

SCHEMBL7142364

CC1=C([Si](C)(C)C2=C(C)c3cccc4cccc2c34)c2cccc3cccc1c23.[Zr]C1C=Cc2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
Hydrochloric Acid SCHEMBL1240934 0.85 ALDH1A1 (0.31) ALDH1A1TSHRMAPK1ATMHSD17B10
Hydrochloric Acid SCHEMBL5352162 0.85 ALDH1A1 (0.31) ALDH1A1TSHRMAPK1ATMHSD17B10
SCHEMBL6890162 0.83
Hydrochloric Acid SCHEMBL5949214 0.75
Hydrochloric Acid SCHEMBL6548637 0.75
Hydrochloric Acid SCHEMBL6548263 0.74
SCHEMBL6890779 0.72
SCHEMBL814489 0.71 HTR2A (0.41) ALDH1A1HSD17B10
SCHEMBL29758183 0.71 HTR2A (0.41) ALDH1A1HSD17B10
SCHEMBL16296388 0.71 HTR2A (0.41) ALDH1A1HSD17B10

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-0859800-B1 SUPPORTED CATALYST SYSTEM, PROCESS FOR ITS PRODUCTION AND ITS USE IN POLYMERISING OLEFINES BASELL POLYOLEFINE GMBH (DE) 2003-07-23 EP claimed