SCHEMBL2384986

SCHEMBL2384986

Cc1ccc(C2=Cc3c(ccc(C)c3-c3cccc(Cl)c3)C2[Zr](Cl)(Cl)(C2C(c3ccc(C)o3)=Cc3c2ccc(C)c3-c2cccc(Cl)c2)=[Si](C)C)o1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.33
S1PR4 O95977 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
IKBKE Q14164 1/20 0.31
SOS1 Q07889 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
SCHEMBL2239245 0.91 SLC9A1 (0.31) SLC9A1
SCHEMBL17060127 0.90 S1PR4 (0.30) SLC9A1S1PR4
SCHEMBL2234457 0.90 PTGS1 (0.35)
SCHEMBL2236798 0.89 SLC9A1 (0.34) SLC9A1ALDH1A1SOS1
SCHEMBL2238629 0.88 SLC9A1 (0.33) SLC9A1S1PR4ALDH1A1CYP1A2IKBKE
SCHEMBL2234158 0.88
SCHEMBL2235919 0.88 PTGS1 (0.34) ALDH1A1
SCHEMBL2237048 0.87
SCHEMBL2236626 0.87 MAPT (0.42) SLC9A1ALDH1A1CYP1A2
SCHEMBL2236392 0.87

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
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

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 SLC9A1 4356/4885S1PR4 2768/4885ALDH1A1 477/4885

“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.