SCHEMBL1002805

SCHEMBL1002805

CCC(CC1CO1)[Si](C)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.31
MAPK1 P28482 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
SCHEMBL27801124 0.88
SCHEMBL15271389 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5049807 0.75 ALDH1A1 (0.31) ALDH1A1
SCHEMBL7696147 0.72 ALDH1A1 (0.33) ALDH1A1
SCHEMBL238323 0.69 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5157585 0.69 ALDH1A1 (0.31) ALDH1A1
SCHEMBL15618088 0.68 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1
SCHEMBL2287051 0.68 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1
SCHEMBL2287054 0.68 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1
SCHEMBL2292972 0.68 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2237670-B1 HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS MOMENTIVE PERFORMANCE MAT INC (US) 2014-10-22 EP disclosed
EP-2237673-B1 MIXTURES OF HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS MOMENTIVE PERFORMANCE MAT INC (US) 2014-09-10 EP disclosed
US-8470894-B2 Hydrolysis resistant organomodified trisiloxane ionic surfactants MOMENTIVE PERFORMANCE MATERIALS (US) 2013-06-25 US disclosed
US-8263669-B2 Hydrolysis resistant organomodified trisiloxane ionic surfactants MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2012-09-11 US disclosed
US-20120142535-A1 HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS MOMENTIVE PERFORMANCE MATERIALS INC. 2012-06-07 US disclosed
US-20110028569-A1 MIXTURES OF HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS MOMENTIVE PERFORMANCE MATERIALS INC. 2011-02-03 US disclosed
US-20110021644-A1 HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS MOMENTIVE PERFORMANCE MATERIALS INC. 2011-01-27 US disclosed
US-20090173912-A1 MIXTURES OF HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2009-07-09 US disclosed
US-20090176893-A1 HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2009-07-09 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 (3 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-20110028569-A1 MIXTURES OF HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS CHRM1, CHRM2, CD209 ALDH1A1 4311/4885TSHR 29/4885MAPK1 3158/4885
US-20090176893-A1 HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS CHRM2, CHRM1, MSR1 ALDH1A1 3424/4885TSHR 327/4885MAPK1 3828/4885
US-20120142535-A1 HYDROLYSIS RESISTANT ORGANOMODIFIED TRISILOXANE IONIC SURFACTANTS CHRM2, CHRM1, MSR1 ALDH1A1 3518/4885TSHR 302/4885MAPK1 3710/4885

“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.