SCHEMBL7182826

SCHEMBL7182826

CCCCc1ccc(-c2cccc3c2C2=C(CCC)C3[Zr]C3C(CCC)=C(c4c(-c5ccc(CCCC)cc5)cccc43)[Si]2(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 2/20 0.34
HSD11B1 P28845 3/20 0.32
RARB P10826 1/20 0.32
CTSV O60911 1/20 0.31
CTSL P07711 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
SCHEMBL7194254 0.97 BRS3 (0.35) BRS3HSD11B1RARBCTSVCTSL
SCHEMBL7189564 0.96 HSD17B10 (0.34) HSD11B1RARBCTSVCTSL
SCHEMBL7182585 0.95 BRS3 (0.32) BRS3
SCHEMBL7189793 0.94 BRS3 (0.35) BRS3HSD11B1RARBCTSVCTSL
SCHEMBL7194423 0.93 HSD17B10 (0.34) BRS3HSD11B1RARBCTSVCTSL
SCHEMBL7194525 0.93 HSD17B10 (0.34) BRS3HSD11B1RARBCTSVCTSL
SCHEMBL7191351 0.92 HSD17B10 (0.35) HSD11B1RARBCTSVCTSL
SCHEMBL7184015 0.91 HSD17B10 (0.32) HSD11B1RARBCTSVCTSL
SCHEMBL7194232 0.91 EDNRB (0.33) BRS3
SCHEMBL7187654 0.91 HSD11B1 (0.35) BRS3HSD11B1RARB

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-1054911-B1 CATALYST SYSTEM, METHOD FOR THE PRODUCTION THEREOF AND ITS USE FOR THE POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2003-01-22 EP claimed