SCHEMBL4649341

SCHEMBL4649341

CC(C)([SiH3])c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 3/20 0.46
TAAR1 Q96RJ0 1/20 0.46
ALOX15 P16050 1/20 0.46
ESR1 P03372 3/20 0.44
ESR2 Q92731 3/20 0.44
CYP3A4 P08684 1/20 0.44
KCNN4 O15554 3/20 0.43
TSHR P16473 2/20 0.43
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
CYP2B6 P20813 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39

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
SCHEMBL859321 0.81 MAPK1 (0.50) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL307045 0.81 MAPK1 (0.50) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL15302136 0.79 MAPK1 (0.48) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL15302535 0.77 ALDH1A1 (0.52) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL9364930 0.77 MAPK1 (0.46) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL15302768 0.77 TSHR (0.52) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL10812897 0.75 MAPK1 (0.50) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL96177 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1
Tert-Butylbenzene SCHEMBL22264597 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1
Tert-Butylbenzene SCHEMBL22264599 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638144-A Synthesis method of heteroaryl silane 南阳师范学院 2024-09-13 CN claimed
CN-117865999-A Preparation method of silicon-based benzazepine-ketone compound 烟台大学 2024-04-12 CN claimed
CN-115954549-A Magnesium battery electrolyte, preparation method and magnesium battery 重庆长安新能源汽车科技有限公司 2023-04-11 CN claimed
US-10189867-B2 Organosilicon modified photoinitiator and a photo-curable adhesive composition comprising the same Henkel IP & Holding GmbH (DE) 2019-01-29 US claimed
EP-3186263-A1 ORGANOSILICON MODIFIED PHOTOINITIATOR AND PHOTO-CURABLE ADHESIVE COMPOSITION THEREOF Henkel AG & Co. KGaA (DE) 2017-07-05 EP claimed
US-20170166594-A1 Organosilicon modified photoinitiator and a photo-curable adhesive composition comprising the same HENKEL (CHINA) COMPANY LIMITED (CN) 2017-06-15 US claimed
US-9505718-B2 3-piperidone compounds and their use as neurokinin-1 (NK1) receptor antagonists NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-11-29 US claimed
WO-2016029439-A1 ORGANOSILICON MODIFIED PHOTOINITIATOR AND PHOTO-CURABLE ADHESIVE COMPOSITION THEREOF HENKEL (CHINA) COMPANY LIMITED (CN) 2016-03-03 WO claimed
US-20160031817-A1 3-PIPERIDONE COMPOUNDS AND THEIR USE AS NEUROKININ-1 (NK1) RECEPTOR ANTAGONISTS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-02-04 US claimed
WO-2014142761-A1 3-PIPERIDONE COMPOUNDS AND THEIR USE AS NEUROKININ-1 (NK1) RECEPTOR ANTAGONISTS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2014-09-18 WO claimed
EP-0458060-B1 Agent for preserving wood and wooden materials DESOWAG MATERIALSCHUTZ GMBH (DE) 1995-10-11 EP claimed
EP-0458061-B1 Agent for preserving wood and wooden materials DESOWAG MATERIALSCHUTZ GMBH (DE) 1995-10-11 EP claimed
US-4748262-A (Phenyl dimethyl carbinyl) silane compound and a method for the preparation thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-05-31 US claimed
CN-118496627-B FRP composite material and preparation method and application thereof 南京斯贝尔复合材料仪征有限公司 2024-10-22 CN disclosed
CN-118638144-A Synthesis method of heteroaryl silane 南阳师范学院 2024-09-13 CN disclosed
CN-118496627-A FRP composite material and preparation method and application thereof 南京斯贝尔复合材料仪征有限公司 2024-08-16 CN disclosed
EP-0963996-A2 Novel transition metal compound, catalyst component for olefin polymerization and process for the preparation of alpha-olefin polymer Japan Polychem Corporation (JP) 1999-12-15 EP disclosed
US-5516956-A SILICA BINDERS FOR ZEOLITE CATALYSTS FOR ISOMERIZATION MOBIL OIL CORPORATION (US) 1996-05-14 US disclosed
US-4748262-A (Phenyl dimethyl carbinyl) silane compound and a method for the preparation thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-05-31 US disclosed
US-4748262-A (Phenyl dimethyl carbinyl) silane compound and a method for the preparation thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-05-31 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-10189867-B2 Organosilicon modified photoinitiator and a photo-curable adhesive composition comprising the same ITGB2, ITGB8, C3AR1 MAPK1 3496/4885ALDH1A1 1399/4885TAAR1 1153/4885
US-20160031817-A1 3-PIPERIDONE COMPOUNDS AND THEIR USE AS NEUROKININ-1 (NK1) RECEPTOR ANTAGONISTS TACR1, NPSR1, TACR2 MAPK1 1117/4885ALDH1A1 1229/4885TAAR1 241/4885
US-20170166594-A1 Organosilicon modified photoinitiator and a photo-curable adhesive composition comprising the same ITGB2, ITGB8, C3AR1 MAPK1 3581/4885ALDH1A1 1378/4885TAAR1 1208/4885

“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.