SCHEMBL2235207

SCHEMBL2235207

COc1ccc(-c2c(C)ccc3c2C=C(c2occ4ccccc24)C3[Zr](Cl)(Cl)(C2C(c3occ4ccccc34)=Cc3c2ccc(C)c3-c2ccc(OC)cc2)=[Si](C)C)cc1

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31
ERBB3 P21860 1/20 0.31
KDR P35968 1/20 0.31
PTK2 Q05397 1/20 0.31
ALOX5 P09917 1/20 0.31
SYK P43405 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MYB P10242 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
UBE2N P61088 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2235558 0.93 CASP3 (0.30)
SCHEMBL2237749 0.92
SCHEMBL2234338 0.92
SCHEMBL2234896 0.90 IKBKB (0.31)
SCHEMBL2234452 0.89
SCHEMBL2235645 0.89 TDP1 (0.32) ALOX5KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL2234111 0.89
SCHEMBL2233385 0.89
SCHEMBL2236613 0.88
SCHEMBL2234831 0.88

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 4 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
US-8461365-B2 Metallocene complex and polymerization method of olefin JAPAN POLYPROPYLENE CORPORATION (JP) 2013-06-11 US disclosed
US-20110230622-A1 METALLOCENE COMPLEX AND POLYMERIZATION METHOD OF OLEFIN JAPAN POLYPROPYLENE CORPORATION (JP) 2011-09-22 US disclosed
EP-2360163-A1 METALLOCENE COMPLEX AND METHOD FOR POLYMERIZING OLEFIN Japan Polypropylene Corporation (JP) 2011-08-24 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110230622-A1 METALLOCENE COMPLEX AND POLYMERIZATION METHOD OF OLEFIN ALOX12, ALOX15, ALOX15B EGFR 587/4885ERBB2 502/4885ERBB3 737/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.