SCHEMBL2235102

SCHEMBL2235102

Cc1ccc(C)c(-c2c(C)ccc3c2C=C(c2ccc(C)o2)C3[Zr](C2C(c3ccc(C)o3)=Cc3c2ccc(C)c3-c2cc(C)ccc2C)=[Si](C)C)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 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
SCHEMBL2236952 0.88
SCHEMBL2235304 0.83
SCHEMBL17096815 0.82 PTGS1 (0.36)
SCHEMBL15810028 0.82
Hydrochloric Acid SCHEMBL17096874 0.81 PTGS1 (0.36)
SCHEMBL15810075 0.80 PTGS1 (0.35) MEN1ALDH1A1HPGDKMT2A
SCHEMBL2234872 0.80 SLC9A1 (0.33) SLC9A1MEN1ALDH1A1HPGDKMT2A
SCHEMBL2236152 0.80 SLC9A1 (0.34) SLC9A1MEN1ALDH1A1HPGDKMT2A
SCHEMBL2236265 0.79 IKBKB (0.31)
SCHEMBL2234900 0.79 SLC9A1 (0.31) SLC9A1MEN1ALDH1A1HPGDKMT2A

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-2360163-B1 METALLOCENE COMPLEX AND METHOD FOR POLYMERIZING OLEFIN JAPAN POLYPROPYLENE CORP (JP) 2014-06-25 EP disclosed
EP-2360163-A1 METALLOCENE COMPLEX AND METHOD FOR POLYMERIZING OLEFIN Japan Polypropylene Corporation (JP) 2011-08-24 EP disclosed