SCHEMBL4432160

SCHEMBL4432160

CCCCCOc1c(C(C)(C)C)cc(C)cc1[Si](Cl)(CC)CC

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
THRB P10828 6/20 0.33
THRA P10827 5/20 0.33
ALDH1A1 P00352 2/20 0.31
CA2 P00918 1/20 0.31
POLB P06746 1/20 0.31
TYR P14679 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
RXRA P19793 2/20 0.30
PPARG P37231 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 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
SCHEMBL4412722 0.81 ALDH1A1 (0.35) CYP3A4CYP2D6ALDH1A1CA2POLB
SCHEMBL1905083 0.80 CYP3A4 (0.32) CYP3A4CYP2D6ALDH1A1CA2POLB
SCHEMBL4413338 0.73 CNR1 (0.33) CYP3A4CYP2D6RXRARXRBRXRG
SCHEMBL4887381 0.73 CYP3A4 (0.31) CYP3A4CYP2D6
SCHEMBL4889490 0.68 CYP3A4 (0.34) CYP3A4CYP2D6
SCHEMBL28234757 0.67 THRA (0.39) CYP3A4CYP2D6THRBTHRARXRA
SCHEMBL5908087 0.67 RXRA (0.47) CYP3A4CYP2D6THRBTHRAALDH1A1
SCHEMBL17430868 0.66 ESR1 (0.43) ALDH1A1
SCHEMBL2914677 0.66 CYP3A4 (0.36) CYP3A4CYP2D6ALDH1A1CA2POLB
SCHEMBL16994842 0.65 MAPT (0.53) CYP2D6THRBTHRAALDH1A1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615660-B2 Production process of alkoxy-titanium complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-10 US disclosed
US-20080306293-A1 Production Process of Alkoxy-Titanium Complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-12-11 US disclosed
EP-1845101-A1 METHOD FOR PRODUCING ALKOXYTITANIUM COMPLEX Sumitomo Chemical Company, Limited (JP) 2007-10-17 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-20080306293-A1 Production Process of Alkoxy-Titanium Complex ABL1, H1-10, ALK CYP3A4 165/4885CYP2D6 505/4885THRB 402/4885

“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.