SCHEMBL830787

SCHEMBL830787

CC1=Cc2c(cccc2-n2c3ccccc3c3ccccc32)C1[Zr](C1C(C)=Cc2c1cccc2-n1c2ccccc2c2ccccc21)=[Si](C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL19813085 0.85 ALDH1A1 (0.35) ALDH1A1
SCHEMBL3690622 0.84 ALDH1A1 (0.34) ALDH1A1
SCHEMBL20943524 0.84 ALDH1A1 (0.31) ALDH1A1
Hydrochloric Acid SCHEMBL16393441 0.83
Hydrochloric Acid SCHEMBL16393792 0.83 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18188583 0.82 ALDH1A1 (0.33) ALDH1A1
Hydrochloric Acid SCHEMBL19326731 0.78 BIRC5 (0.31)
Hydrochloric Acid SCHEMBL16393800 0.76
Bromide SCHEMBL830896 0.76 ALDH1A1 (0.32) ALDH1A1
Hydrochloric Acid SCHEMBL831357 0.76 ALDH1A1 (0.32) ALDH1A1

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
EP-4119568-B1 NOVEL METALLOCENE COMPOUND, CATALYST COMPOSITION COMPRISING THE SAME, AND METHOD FOR PREPARING OLEFIN POLYMER USING THE SAME LG CHEMICAL LTD (KR) 2026-05-20 EP disclosed
US-8143353-B2 Polymerization process and adhesives therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-27 US disclosed