SCHEMBL3615489

SCHEMBL3615489

C=C(C)C(=O)OC(CC)[SiH2]C(OCC)(OCC)OCC

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.35
TSHR P16473 3/20 0.33
ALDH1A1 P00352 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
SCHEMBL16537558 0.86 THRB (0.34) THRBTSHRALDH1A1
SCHEMBL16537913 0.84 THRB (0.33) THRBTSHR
SCHEMBL16537955 0.77 ALDH1A1 (0.35) THRBTSHRALDH1A1
SCHEMBL16537374 0.76 ALDH1A1 (0.34) THRBTSHRALDH1A1
SCHEMBL1019849 0.75 TSHR (0.39) THRBTSHRALDH1A1
SCHEMBL28355809 0.75 TSHR (0.35) THRBTSHR
SCHEMBL28352185 0.75 TSHR (0.40) THRBTSHRALDH1A1
SCHEMBL27415907 0.74 TSHR (0.38) THRBTSHRALDH1A1
SCHEMBL16537588 0.74 THRB (0.33) THRBTSHRALDH1A1
Hydrogen Sulfide SCHEMBL23421906 0.73 THRB (0.37) THRBTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010026491-A2 PROCEDURE TO REMOVE PIGMENTARY STAINS AND TATOOS ON THE SKIN BY A SOLID-STATE DYE LASER SYSTEM CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2010-03-11 WO claimed
US-8486428-B2 Compositions and methods for making and using acyclic N-halamine-based biocidal polymeric materials and articles BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-07-16 US disclosed
WO-2010026491-A2 PROCEDURE TO REMOVE PIGMENTARY STAINS AND TATOOS ON THE SKIN BY A SOLID-STATE DYE LASER SYSTEM CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2010-03-11 WO disclosed
WO-2007126775-A2 COMPOSITIONS AND METHODS FOR MAKING AND USING ACYCLIC N-HALAMINE-BASED BIOCIDAL POLYMERIC MATERIALS AND ARTICLES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-11-08 WO disclosed
US-20070224161-A1 Compositions and methods for making and using acyclic N-halamine-based biocidal polymeric materials and articles BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-09-27 US disclosed
US-7008990-B2 Use of polymeric reaction product BASF AKTIENGESELLSCHAFT (DE) 2006-03-07 US disclosed
US-20030170306-A1 Use of polymeric reaction product BASF AKTIENGESELLSCHAFT (DE) 2003-09-11 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-20070224161-A1 Compositions and methods for making and using acyclic N-halamine-based biocidal polymeric materials and articles NAAA, NIT2, AADAC THRB 4336/4885TSHR 4421/4885ALDH1A1 1154/4885
US-20030170306-A1 Use of polymeric reaction product OXSR1, OGFR, CBR1 THRB 392/4885TSHR 80/4885ALDH1A1 2250/4885

“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.