SCHEMBL333453

SCHEMBL333453

c1cc2c(c3c1CC3)CC2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.36
HTR2A P28223 3/20 0.36
HTR2C P28335 3/20 0.36
HTR2B P41595 3/20 0.36
PNMT P11086 3/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
BCL2L1 Q07817 1/20 0.32
BAD Q92934 1/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
PARP1 P09874 1/20 0.30

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
SCHEMBL23944932 0.77 PARP1 (0.46) CES1PNMTBCL2L1BADTSHR
SCHEMBL23674439 0.76 HTR2C (0.38) HTR2AHTR2CHTR2BPNMTADRA2A
SCHEMBL7271975 0.73 EGFR (0.42) ADRA2AADRA2BADRA2CBCL2L1BAD
SCHEMBL2534784 0.71 PNMT (0.55) HTR2AHTR2CHTR2BPNMTADRA2A
SCHEMBL22632718 0.69 HTR2A (0.41) HTR2AHTR2CHTR2BPNMTADRA2A
SCHEMBL5399458 0.68 CES1 (0.38) CES1KDM4EALDH1A1LMNAMAPT
SCHEMBL7444249 0.66
SCHEMBL3976079 0.66
SCHEMBL24011796 0.66
SCHEMBL22493786 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856201-B1 PROCESS FOR CROSSLINKING POLYMER WITH LOW VOC-PRODUCING SILANE CROSSLINKER MOMENTIVE PERFORMANCE MAT INC (US) 2019-08-14 EP claimed
EP-2241583-B1 CROSSLINKABLE SILANE-TERMINATED POLYMER AND SEALANT COMPOSITION MADE WITH SAME MOMENTIVE PERFORMANCE MAT INC (US) 2018-10-03 EP claimed
EP-1888663-B1 CROSSLINKABLE SILANE-TERMINATED POLYMER AND SEALANT COMPOSITION MADE WITH SAME MOMENTIVE PERFORMANCE MAT INC (US) 2018-08-08 EP claimed
EP-2708546-B1 Halo-Functional Silane, process for its preparation, rubber composition containing same and articles manufactured therefrom MOMENTIVE PERFORMANCE MAT INC (US) 2016-01-06 EP claimed
EP-1858968-B1 FILLER TREATMENTS UTILIZING LOW VOC SILANES MOMENTIVE PERFORMANCE MAT INC (US) 2015-12-09 EP claimed
EP-2708546-A1 Halo-Functional Silane, process for its preparation, rubber composition containing same and articles manufactured therefrom Momentive Performance Materials Inc. (US) 2014-03-19 EP claimed
EP-2207782-B1 HALO-FUNCTIONAL SILANE, PROCESS FOR ITS PREPARATION, RUBBER COMPOSITION CONTAINING SAME AND ARTICLES MANUFACTURED THEREFROM MOMENTIVE PERFORMANCE MAT INC (US) 2014-02-26 EP claimed
EP-1270581-B1 Blocked mercaptosilane coupling agents for filled rubbers MOMENTIVE PERFORMANCE MAT INC (US) 2014-02-19 EP claimed
US-8158812-B2 Diol-derived organofunctional silane and compositions containing same Momentive Performance Marerials Inc. (US) 2012-04-17 US claimed
US-20110213074-A1 DIOL-DERIVED ORGANOFUNCTIONAL SILANE AND COMPOSITIONS CONTAINING SAME MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2011-09-01 US claimed
US-20060063879-A1 Tire with low volatile alcohol emission rubber tread with compositional limitations GOODYEAR TIRE & RUBBER COMPANY, THE 2006-03-23 US claimed
WO-2006019963-A1 DIOL-DERIVED ORGANOFUNCTIONAL SILANE AND COMPOSITIONS CONTAINING SAME GENERAL ELECTRIC COMPANY (US) 2006-02-23 WO claimed
US-20060036034-A1 Diol-derived organofunctional silane and compositions containing same GENERAL ELECTRIC COMPANY 2006-02-16 US claimed
US-20050245753-A1 Cyclic diol-derived blocked mercaptofunctional silane compositions MOMENTIVE PERFORMANCE MATERIALS INC. 2005-11-03 US claimed
CN-1643145-A Purification methods for oligonucleotides and their analogs AVECIA BIOTECHNOLOGY INC (US) 2005-07-20 CN claimed
US-20030199619-A1 Blocked mercaptosilane hydrolyzates as coupling agents for mineral-filled elastomer compositions CROMPTON CORPORATION 2003-10-23 US claimed
EP-0877592-B1 HAIR CONDITIONING COMPOSITIONS PROCTER & GAMBLE (US) 2002-09-18 EP claimed
EP-0877591-B1 HAIR CONDITIONING COMPOSITIONS PROCTER & GAMBLE (US) 2002-09-18 EP claimed
US-6106814-A CATIONIC, CROSSLINKED POLYMER HAVING DIALKYLAMINOALKYL (METH)ACRYLATE OR QUATERNARY MONOMER(S); POLYOXYALKYLENE GLYCOL, SALT, AND POLAR SOLVENT; ATOMIZABLE, LEAVE-ON HAIR THE PROCTER & GAMBLE COMPANY (US) 2000-08-22 US claimed
US-3966711-A 4-Alkyl-1,4-diaza-5-oxo-cycloheptanes and their 1-oxyls CIBA-GEIGY CORPORATION (US) 1976-06-29 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20110213074-A1 DIOL-DERIVED ORGANOFUNCTIONAL SILANE AND COMPOSITIONS CONTAINING SAME OR51E2, FANCF, DDT CES1 1920/4885HTR2A 3675/4885HTR2C 3086/4885

“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.