SCHEMBL758122

SCHEMBL758122

C=C(C)COCC[N+](C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 6/20 0.43
CHRM1 P11229 6/20 0.43
CHRM3 P20309 6/20 0.43
CHRM2 P08172 5/20 0.43
CHRM4 P08173 5/20 0.43
CHRNB2 P17787 4/20 0.43
CHRNA4 P43681 4/20 0.43
CHRNA7 P36544 3/20 0.43
HTR1A P08908 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
PGR P06401 1/20 0.43
TBXA2R P21731 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA10 Q9GZZ6 1/20 0.43
CHRNA9 Q9UGM1 1/20 0.43
GALR3 O60755 2/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
ADRA2A P08913 1/20 0.38

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
Bromide SCHEMBL366431 0.98 GALR3 (0.45) CHRM5CHRM1CHRM3CHRM2CHRM4
Iodide SCHEMBL10787028 0.98 CHRM5 (0.41) CHRM5CHRM1CHRM3CHRM2CHRM4
Hydrochloric Acid SCHEMBL366719 0.98 CHRM5 (0.45) CHRM5CHRM1CHRM3CHRM2CHRM4
Sulfuric Acid SCHEMBL9636228 0.88 CHRM5 (0.39) CHRM5CHRM1CHRM3CHRM2CHRM4
Hydrochloric Acid SCHEMBL11134213 0.85 APEX1 (0.39) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL5492345 0.84 POLB (0.37) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL1598351 0.82 DNM1 (0.33) CHRNA7CHRNB4CHRNA3KMT2A
SCHEMBL1597437 0.80 CHRM4 (0.33) CHRM1CHRM3CHRM2CHRM4
SCHEMBL631462 0.79 HSD17B10 (0.37) TSHRMEN1KMT2A
SCHEMBL4051767 0.79 DNM1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3600220-B1 POLYPHENOLS/PEG BASED HYDROGEL SYSTEM FOR A DENTAL VARNISH DENTSPLY SIRONA INC (US) 2023-03-22 EP claimed
EP-3102079-B1 DISPERSIBLE HYDROENTANGLED BASESHEET WITH TRIGGERABLE BINDER KIMBERLY CLARK CO (US) 2023-01-04 EP claimed
EP-3143098-B1 POLYMER AND SURFACTANT COMPOSITIONS AND THEIR USES FOR THE IMPROVED RECOVERY OF HYDROCARBONS TOTAL SE (FR) 2021-02-10 EP claimed
EP-3234022-B1 PARTICLES FOR ELECTROPHORETIC DISPLAYS MERCK PATENT GMBH (DE) 2020-01-29 EP claimed
EP-2834705-B1 PARTICLES FOR ELECTROPHORETIC DISPLAYS COMPRISING A CORE AND A RANDOM-COPOLYMER COATING MERCK PATENT GMBH (DE) 2018-12-05 EP claimed
EP-2744399-B1 CONTROL OF BIOFOULING IN IMPLANTABLE BIOSENSORS UNIV CONNECTICUT (US) 2017-07-12 EP claimed
EP-2384375-B1 ELECTROSPINNING OF PTFE WITH HIGH VISCOSITY MATERIALS ZEUS IND PRODUCTS INC (US) 2017-07-05 EP claimed
EP-1585502-B9 FAST-DISINTEGRATING SOLID DOSAGE FORMS BEING NOT FRIABLE AND COMPRISING PULLULAN ELAN PHARMA INT LTD (IE) 2012-05-09 EP claimed
EP-1937733-B1 PROCESS FOR PREPARING AN AQUEOUS DISPERSION OF A QUATERNARY AMMONIUM SALT CONTAINING VINYL COPOLYMER BOSTIK INC (US) 2009-12-30 EP claimed
EP-1814511-B1 METHOD FOR THE PERMANENT SHAPING OF HAIR USING A CATIONIC CELLULOSE DERIVATIVE PROCTER & GAMBLE (US) 2009-12-23 EP claimed
US-20080031846-A1 Compositions with enhanced antimicrobial efficacy against acanthamoebae BORAZJANI ROYA 2008-02-07 US claimed
EP-1852133-A2 Compositions with enhanced antimicrobial efficacy against acanthamoebae BAUSCH & LOMB INCORPORATED (US) 2007-11-07 EP claimed
EP-1443912-B1 COMPOSITIONS HAVING A COMBINATION OF IMMEDIATE RELEASE AND CONTROLLED RELEASE CHARACTERISTICS ELAN PHARMA INT LTD (IE) 2007-08-29 EP claimed
EP-1539259-B1 WET WIPES COMPRISING ION TRIGGERABLE, CATIONIC POLYMERS KIMBERLY CLARK CO (US) 2007-07-25 EP claimed
EP-1429731-B1 NANOPARTICULATE INSULIN FORMULATIONS ELAN PHARMA INT LTD (IE) 2007-01-03 EP claimed
EP-0920487-B1 COMPOSITION AND METHOD FOR INHIBITING THE DEPOSITION OF PROTEIN ON CONTACT LENS BAUSCH & LOMB (US) 2003-04-09 EP claimed
US-6096138-A IMMERSION IN AQUEOUS SOLUTION OF POLYQUATERNARY AMMONIUM SALT CATIONIC POLYMER BAUSCH & LOMB INCORPORATED (US) 2000-08-01 US claimed
EP-0559851-B1 HAIR-SETTING AGENT AND A HAIR-PERMING METHOD USING THIS AGENT WELLA AG (DE) 1995-08-23 EP claimed
EP-0398019-B1 Direct electroplating of through-holes IBM (US) 1995-07-12 EP claimed
EP-0356665-B1 CATIONIC FIXATION COMPOSITION AND PROCESS FOR THE PERMANENT WAVING OF HAIR Wella Aktiengesellschaft (DE) 1992-06-03 EP 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-20080031846-A1 Compositions with enhanced antimicrobial efficacy against acanthamoebae LAGE3, PKD2, CUTA CHRM5 4271/4885CHRM1 2792/4885CHRM3 3319/4885

“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.