SCHEMBL2007179

SCHEMBL2007179

C[Si](C)(CN)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
LOXL2 Q9Y4K0 2/20 0.38
TAAR1 Q96RJ0 7/20 0.36
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
HTR2A P28223 2/20 0.35
CYP2A6 P11509 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAOA P21397 2/20 0.34
MAOB P27338 1/20 0.34
MGAM O43451 1/20 0.34
NOTUM Q6P988 3/20 0.33
DPP4 P27487 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
Hydrochloric Acid SCHEMBL16880772 0.97 MAPT (0.42) MAPTESR1ESR2LOXL2TAAR1
Fluoride SCHEMBL27920006 0.97 MAPT (0.42) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL27474368 0.97 MAPT (0.42) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL2012877 0.80 MAPT (0.41) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL9339400 0.79 ESR1 (0.39) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL9217667 0.78 MAPT (0.47) MAPTESR1ESR2NR1H2NR1H3
SCHEMBL3865502 0.77 MGAM (0.40) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL9226507 0.76 MAPT (0.45) MAPTESR1ESR2NR1H2NR1H3
SCHEMBL2008775 0.75 TAAR1 (0.39) TAAR1HTR2ACYP2A6MAOBNOTUM
SCHEMBL2006055 0.75 LOXL2 (0.42) MAPTLOXL2TAAR1NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10053472-B2 Silicon-based fungicides and process for producing the same COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2018-08-21 US claimed
EP-3089985-B1 SILICON-BASED FUNGICIDES AND PROCESS FOR PRODUCING THE SAME COUNCIL SCIENT IND RES (IN) 2018-06-27 EP claimed
CN-106832376-A Complex made of heterogeneous material and preparation method, electronic installation 河源市美晨联合智能硬件电子研究院 2017-06-13 CN claimed
EP-2782920-B1 FUNGICIDE N-[(TRISUBSTITUTEDSILYL)METHYL]-CARBOXAMIDE DERIVATIVES BAYER IP GMBH (DE) 2016-12-21 EP claimed
US-20160326190-A1 SILICON-BASED FUNGICIDES AND PROCESS FOR PRODUCING THE SAME COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-11-10 US claimed
EP-3089985-A1 SILICON-BASED FUNGICIDES AND PROCESS FOR PRODUCING THE SAME Council of Scientific and Industrial Research (IN) 2016-11-09 EP claimed
WO-2015102025-A1 SILICON-BASED FUNGICIDES AND PROCESS FOR PRODUCING THE SAME COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-07-09 WO claimed
US-20140315858-A1 FUNGICIDE N-[(TRISUBSTITUTEDSILYL)METHYL]-CARBOXAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-10-23 US claimed
EP-2782920-A1 FUNGICIDE N-[(TRISUBSTITUTEDSILYL)METHYL]-CARBOXAMIDE DERIVATIVES Bayer Intellectual Property GmbH (DE) 2014-10-01 EP claimed
CN-103958531-A Fungicide N-[(trisubstitutedsilyl)methyl]-carboxamide derivatives BAYER IP GMBH 2014-07-30 CN claimed
WO-2013075817-A1 FUNGICIDE N-[(TRISUBSTITUTEDSILYL)METHYL]-CARBOXAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-05-30 WO claimed
US-7964738-B2 Pharmaceutical compositions and methods of use of lipophilic, silicon-substituted, cyclooxygenase-2 selective non-steroidal anti-inflammatory drugs and derivatives SILAMED, INC. (US) 2011-06-21 US claimed
US-20070129331-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF LIPOPHILIC, SILICON-SUBSTITUTED, CYCLOOXYGENASE-2 SELECTIVE NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND DERIVATIVES RND PHARMACEUTICALS, INC. (US) 2007-06-07 US claimed
EP-1737471-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF LIPOPHILIC, SILICON-SUBSTITUTED, CYCLOOXYGENASE-2 SELECTIVE NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND DERIVATIVES RND Pharmaceuticals (US) 2007-01-03 EP claimed
WO-2005102358-A2 SILICONE-SUBSTITUTED COX-2 SELECTIVE INHIBITORS RND PHARMACEUTICALS (US) 2005-11-03 WO claimed
US-11129790-B2 Chemo-enzymatic site-specific modification of peptides and proteins to form cleavable conjugates NORTHEASTERN UNIVERSITY (US) 2021-09-28 US disclosed
US-20200341395-A1 TONER CANON KABUSHIKI KAISHA (JP) 2020-10-29 US disclosed
US-5089620-A Monlinear optical effects DOW CORNING TORAY SILICONE COMPANY, LTD. (JP) 1992-02-18 US disclosed
US-5041589-A Optics DOW CORNING TORAY SILICONE COMPANY, LTD. (JP) 1991-08-20 US disclosed
EP-0404134-A1 Organosilicon compounds and method for their preparation Dow Corning Toray Silicone Company, Limited (JP) 1990-12-27 EP 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 (5 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-20160326190-A1 SILICON-BASED FUNGICIDES AND PROCESS FOR PRODUCING THE SAME CYP51A1, STS, LSS MAPT 2179/4885ESR1 3165/4885ESR2 4200/4885
US-10053472-B2 Silicon-based fungicides and process for producing the same CYP51A1, STS, LSS MAPT 2179/4885ESR1 3165/4885ESR2 4200/4885
US-20140315858-A1 FUNGICIDE N-[(TRISUBSTITUTEDSILYL)METHYL]-CARBOXAMIDE DERIVATIVES TET3, TET1, PFAS MAPT 2807/4885ESR1 4377/4885ESR2 4494/4885
US-11129790-B2 Chemo-enzymatic site-specific modification of peptides and proteins to form cleavable conjugates GLUL, QPCT, DNPEP MAPT 4290/4885ESR1 2812/4885ESR2 2734/4885
US-20070129331-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF LIPOPHILIC, SILICON-SUBSTITUTED, CYCLOOXYGENASE-2 SELECTIVE NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND DERIVATIVES PTGES2, PTGS2, SI MAPT 197/4885ESR1 253/4885ESR2 154/4885

“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.