SCHEMBL10138602

SCHEMBL10138602

CCCOCCOCC(COCCOCCOC)(COCCOCCOC)COCCOCCOC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.32
CA2 P00918 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL12240798 0.90 THRB (0.36) THRBCYP3A4TSHRHSD17B10
SCHEMBL16473877 0.87 THRB (0.35) THRBCYP3A4TSHRHSD17B10
SCHEMBL409546 0.87 THRB (0.33) THRBCA2
SCHEMBL25457062 0.85 HSD17B10 (0.32) THRBHSD17B10
SCHEMBL15199305 0.85 THRB (0.32) THRBCA2
SCHEMBL11570949 0.84 TSHR (0.39) THRBCA2CYP3A4TSHRHSD17B10
SCHEMBL12508099 0.84 TSHR (0.39) THRBCA2CYP3A4TSHRHSD17B10
SCHEMBL10051721 0.84 HSD17B10 (0.38) THRBHSD17B10
SCHEMBL274348 0.84 TSHR (0.39) THRBCA2CYP3A4TSHRHSD17B10
SCHEMBL16546834 0.84 TSHR (0.39) THRBCA2CYP3A4TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130310912-A1 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES (US) 2013-11-21 US disclosed
US-20120046735-A1 PLASMA MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES, INCORPORATED (US) 2012-02-23 US disclosed
US-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES (US) 2012-02-23 US disclosed
US-8066824-B2 Covalent modification of metal surfaces INTEZYNE TECHNOLOGIES, INC. (US) 2011-11-29 US disclosed
US-20080035243-A1 Covalent modification of metal surfaces INTEZYNE TECHNOLOGIES (US) 2008-02-14 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 (2 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-20080035243-A1 Covalent modification of metal surfaces ITGAL, ITGA1, ITGA5 THRB 3826/4885CA2 320/4885CYP3A4 1592/4885
US-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES ITGAL, ITGA1, ITGA5 THRB 3826/4885CA2 320/4885CYP3A4 1592/4885

“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.