SCHEMBL9725035

SCHEMBL9725035

CCC(N=C=S)N(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.46
TRPV1 Q8NER1 2/20 0.46
MIF P14174 2/20 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
SCHEMBL6949939 0.78
SCHEMBL356196 0.77 CYP1A2 (0.32)
SCHEMBL3730646 0.76
Hydrochloric Acid SCHEMBL756845 0.76 CYP1A2 (0.31)
SCHEMBL11852482 0.73 TRPA1 (0.48) TRPA1TRPV1MIF
SCHEMBL5932315 0.71 FDPS (0.31)
SCHEMBL8761274 0.70 MIF (0.56) TRPA1TRPV1MIF
SCHEMBL4460900 0.66
SCHEMBL4563920 0.65
SCHEMBL331115 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240409995-A1 SINGLE-MOLECULE PEPTIDE SEQUENCING THROUGH MOLECULAR BARCODING AND EX-SITU ANALYSIS GLYPHIC BIOTECHNOLOGIES, INC. 2024-12-12 US claimed
CN-111320750-B Weak acid ionizable amphiphilic zwitterionic carrier, micelle drug delivery system, preparation method and application thereof 中国药科大学 2022-03-29 CN claimed
CN-111320750-A Weak acid ionizable amphiphilic zwitterionic carrier, micelle drug delivery system, preparation method and application thereof 中国药科大学 2020-06-23 CN claimed
CN-111320750-B Weak acid ionizable amphiphilic zwitterionic carrier, micelle drug delivery system, preparation method and application thereof 中国药科大学 2022-03-29 CN disclosed
CN-111320750-A Weak acid ionizable amphiphilic zwitterionic carrier, micelle drug delivery system, preparation method and application thereof 中国药科大学 2020-06-23 CN disclosed
EP-3452591-A1 MACROMOLECULE ANALYSIS EMPLOYING NUCLEIC ACID ENCODING Encodia, Inc. (US) 2019-03-13 EP disclosed
US-9968694-B2 Compositions and methods for non-invasive imaging MERRIMACK PHARMACEUTICALS, INC. (US) 2018-05-15 US disclosed
WO-2017192633-A9 MACROMOLECULE ANALYSIS EMPLOYING NUCLEIC ACID ENCODING PROCURE LIFE SCIENCES INC. (US) 2017-12-14 WO disclosed
WO-2017192633-A1 MACROMOLECULE ANALYSIS EMPLOYING NUCLEIC ACID ENCODING PROCURE LIFE SCIENCES INC. (US) 2017-11-09 WO disclosed
US-20170152222-A1 COMPOUNDS AND METHODS FOR INHIBITING PRODUCTION OF TRIMETHYLAMINE THE PROCTER & GAMBLE COMPANY 2017-06-01 US disclosed
US-20170112950-A1 Compositions and Methods for Non-Invasive Imaging MERRIMACK PHARMACEUTICALS, INC. 2017-04-27 US disclosed
US-9511155-B2 Compositions and methods for non-invasive imaging MERRIMACK PHARMACEUTICALS, INC. (US) 2016-12-06 US disclosed
US-20150093328-A1 COMPOSITIONS AND METHODS FOR NON-INVASIVE IMAGING MERRIMACK PHARMACEUTICALS, INC. (US) 2015-04-02 US disclosed
EP-2838880-A1 COMPOSITIONS AND METHODS FOR NON-INVASIVE IMAGING Merrimack Pharmaceuticals, Inc. (US) 2015-02-25 EP disclosed
WO-2013158803-A1 COMPOSITIONS AND METHODS FOR NON-INVASIVE IMAGING MERRIMACK PHARMACEUTICALS, INC. (US) 2013-10-24 WO disclosed
US-5124308-A Reacts with transition metal salt for carbonless paper copying MINNESOTA MINING AND MANUFACTURING COMPANY 1992-06-23 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-20170152222-A1 COMPOUNDS AND METHODS FOR INHIBITING PRODUCTION OF TRIMETHYLAMINE CRAT, CPT1A, CPT1B TRPA1 1355/4885TRPV1 3148/4885MIF 647/4885
US-20150093328-A1 COMPOSITIONS AND METHODS FOR NON-INVASIVE IMAGING MKI67, CA13, FAP TRPA1 4140/4885TRPV1 4133/4885MIF 2575/4885
US-20170112950-A1 Compositions and Methods for Non-Invasive Imaging MKI67, CA13, FAP TRPA1 4140/4885TRPV1 4133/4885MIF 2575/4885

“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.