SCHEMBL873698

SCHEMBL873698

[SiH3]O[SiH2]Cc1ccccc1.[SiH3]O[SiH3]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
CALM1 P0DP23 1/20 0.38
IDO1 P14902 2/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LOXL2 Q9Y4K0 2/20 0.35
TP53 P04637 1/20 0.35
TRPA1 O75762 1/20 0.35
AGXT P21549 1/20 0.34
MAOB P27338 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
CASP1 P29466 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
CYP2A6 P11509 1/20 0.32
HTR2A P28223 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL116134 0.98 TSHR (0.40) TSHRCALM1IDO1CES2CES1
SCHEMBL1072585 0.86 TP53 (0.33) TSHRCALM1IDO1CES2CES1
SCHEMBL9121524 0.82 TSHR (0.31) TSHRALDH1A1TRPA1
SCHEMBL10731613 0.80 TSHR (0.34) TSHRCALM1IDO1ALDH1A1LOXL2
SCHEMBL320639 0.77 TSHR (0.43) TSHRCALM1IDO1ALDH1A1LOXL2
SCHEMBL11494485 0.77 TSHR (0.32) TSHRCALM1IDO1
SCHEMBL11497720 0.77 TSHR (0.32) TSHRCALM1IDO1
SCHEMBL9229144 0.74 IDO1 (0.41) IDO1LOXL2AGXTMAOBTAAR1
SCHEMBL485741 0.74 ALDH1A1 (0.42) TSHRIDO1ALDH1A1LOXL2MAOB
SCHEMBL6001246 0.73 TP53 (0.30) TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2632426-A1 COSMETIC COMPOSITION COMPRISING A FATTY-CHAIN ALKOXYSILANE AND A CATIONIC POLYMER L'Oréal (FR) 2013-09-04 EP disclosed
EP-2632424-A1 COSMETIC COMPOSITION COMPRISING A FATTY-CHAIN ALKOXYSILANE AND A CATIONIC OR NONIONIC SURFACTANT. L'Oréal (FR) 2013-09-04 EP disclosed
EP-2632425-A1 COSMETIC COMPOSITION COMPRISING A FATTY-CHAIN ALKOXYSILANE, AN ANIONIC SURFACTANT AND A NONIONIC, AMPHOTERIC OR ZWITTERIONIC SURFACTANT L'Oréal (FR) 2013-09-04 EP disclosed
EP-2618801-A2 COSMETIC COMPOSITION COMPRISING AT LEAST ONE HYGROSCOPIC SALT, AT LEAST ONE AROMATIC POLYOL ETHER AND AT LEAST ONE DIOL, AND COSMETIC TREATMENT PROCESS L'Oréal (FR) 2013-07-31 EP disclosed
WO-2012110608-A2 PROCESS FOR TREATING KERATIN FIBRES USING A SILICONE ELASTOMER IN COMBINATION WITH HEAT L'OREAL (FR) 2012-08-23 WO disclosed
WO-2012055811-A1 COSMETIC COMPOSITION COMPRISING A FATTY-CHAIN ALKOXYSILANE AND A CATIONIC OR NONIONIC SURFACTANT. L'OREAL (FR) 2012-05-03 WO disclosed
WO-2012055805-A1 COSMETIC COMPOSITION COMPRISING A FATTY-CHAIN ALKOXYSILANE AND A SILICEOUS COSMETIC AGENT. L'OREAL (FR) 2012-05-03 WO disclosed
WO-2012055809-A1 COSMETIC COMPOSITION COMPRISING A FATTY-CHAIN ALKOXYSILANE, AN ANIONIC SURFACTANT AND A NONIONIC, AMPHOTERIC OR ZWITTERIONIC SURFACTANT L'OREAL (FR) 2012-05-03 WO disclosed
WO-2012055807-A1 COSMETIC COMPOSITION COMPRISING A FATTY-CHAIN ALKOXYSILANE AND A CATIONIC POLYMER L'OREAL (FR) 2012-05-03 WO disclosed
WO-2012038536-A2 COSMETIC COMPOSITION COMPRISING AT LEAST ONE HYGROSCOPIC SALT, AT LEAST ONE AROMATIC POLYOL ETHER AND AT LEAST ONE DIOL, AND COSMETIC TREATMENT PROCESS L'OREAL (FR) 2012-03-29 WO disclosed
WO-2012038538-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE QUATERNARY AMMONIUM ESTER AND AT LEAST ONE SOLUBLE SALT OF DIVALENT METALS, AND PROCESS USING THE SAID COMPOSITION L'OREAL (FR) 2012-03-29 WO disclosed
WO-2012038534-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE CALCIUM SALT, AT LEAST ONE FATTY ALCOHOL, AT LEAST ONE CATIONIC SURFACTANT AND AT LEAST ONE THICKENER L'OREAL (FR) 2012-03-29 WO disclosed
US-20080274070-A1 Method for permanently reshaping keratin fibers comprising applying a poorly concentrated reducing compositions followed by drying L'OREAL S.A. (FR) 2008-11-06 US disclosed
US-20080206177-A1 Cosmetic composition comprising at least one cationic polyurethane and at least one polyethylene glycol ester, to be applied during hair dressing L'OREAL, S.A. (FR) 2008-08-28 US disclosed
US-20080206164-A1 Cosmetic composition comprising at least one cationic polyurethane and at least one vinyl pyrrolidone homo- or copolymer, and method of styling therewith L'OREAL S.A. (FR) 2008-08-28 US disclosed
US-20080185014-A1 Method for permanently reshaping keratin fibers comprising applying a poorly concentrated reducing composition and intermediate drying L'OREAL S.A. (FR) 2008-08-07 US disclosed
US-7223720-B2 Dialkyl(ene) alkoxy ether wax, a dialkyl(ene) carbonate, amphoteric and/or zwitterionic surfactant; and a cationic polymer for cleaning keratinous fibres; reduces the combing work on hair COGNIS IP MANAGEMENT GMBH (DE) 2007-05-29 US disclosed
US-20060177399-A1 Pressurized device for hair fiber styling and use of the same for hair fiber styling and/or hair L'OREAL S.A. (FR) 2006-08-10 US disclosed
US-20050202985-A1 Dialkyl(ene) alkoxy ether wax, a dialkyl(ene) carbonate, amphoteric and/or zwitterionic surfactant; and a cationic polymer for cleaning keratinous fibres; reduces the combing work on hair COGNIS IP MANAGEMENT GMBH (DE) 2005-09-15 US disclosed
US-5496544-A CONTAINING MIXTURE OF SILICONE OIL/WAX/RESIN AND OPTIONALLY SILICONE GUM AND PHENYL SIMETHICONE; FACE MAKE-UP, EYE SHADOW, MAKE-UP AND BODY POWDERS L'OREAL (FR) 1996-03-05 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-20080206164-A1 Cosmetic composition comprising at least one cationic polyurethane and at least one vinyl pyrrolidone homo- or copolymer, and method of styling therewith PUF60, SRSF2, PCBP1 TSHR 3039/4885CALM1 3090/4885IDO1 143/4885
US-20080206177-A1 Cosmetic composition comprising at least one cationic polyurethane and at least one polyethylene glycol ester, to be applied during hair dressing CUTA, PHOSPHO1, DSG1 TSHR 4574/4885CALM1 4447/4885IDO1 451/4885
US-20060177399-A1 Pressurized device for hair fiber styling and use of the same for hair fiber styling and/or hair POLR1C, NACA, SHH TSHR 983/4885CALM1 2345/4885IDO1 1913/4885

“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.