SCHEMBL18339282

SCHEMBL18339282

CCCCCCCCCCCc1nccn1CCO

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.46
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
AGTR1 P30556 1/20 0.43
AGTR2 P50052 1/20 0.43
KCNH2 Q12809 2/20 0.40
TLR7 Q9NYK1 3/20 0.38
ALPG P10696 1/20 0.36
PLAA Q9Y263 1/20 0.36

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
SCHEMBL9979698 1.00 TLR8 (0.46) TLR8ALDH1A1POLBKMT2ACA1
SCHEMBL218249 1.00 TLR8 (0.46) TLR8ALDH1A1POLBKMT2ACA1
SCHEMBL29138650 1.00 TLR8 (0.46) TLR8ALDH1A1POLBKMT2ACA1
SCHEMBL9408468 1.00 TLR8 (0.46) TLR8ALDH1A1POLBKMT2ACA1
SCHEMBL216892 1.00 TLR8 (0.46) TLR8ALDH1A1POLBKMT2ACA1
Hydrochloric Acid SCHEMBL28508791 0.98 TLR8 (0.47) TLR8ALDH1A1POLBKMT2ACA1
SCHEMBL31037672 0.94 AGTR1 (0.42) TLR8ALDH1A1POLBKMT2ACA1
SCHEMBL31590567 0.93 ALDH1A1 (0.47) TLR8ALDH1A1POLBKMT2ACA1
SCHEMBL5282914 0.88 TLR8 (0.59) TLR8ALDH1A1POLBKMT2AAGTR1
SCHEMBL2149023 0.88 TLR8 (0.59) TLR8ALDH1A1POLBKMT2AAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108384496-A A kind of black glue and preparation method thereof 上海嘉好胶粘制品有限公司 2018-08-10 CN claimed
EP-3728487-B1 METHOD OF REMOVING POLYMERIC MATERIAL COMPRISING HETEROATOMS FROM A SURFACE USING COMPOSITIONS INCLUDING A KETO-ESTER COMPOUND FOURTH PRINCIPLE LLC (US) 2025-07-02 EP disclosed
WO-2023091342-A1 PRESERVATION SYSTEM FOR STABILIZING SPORE-FORMING MICROBIALS PHIBRO ANIMAL HEALTH CORPORATION (US) 2023-05-25 WO disclosed
US-20230151324-A1 PRESERVATION SYSTEM FOR STABILIZING SPORE-FORMING MICROBIALS PHIBRO ANIMAL HEALTH CORPORATION (US) 2023-05-18 US disclosed
US-11370996-B2 Compositions including keto-ester compounds and methods of using the same FOURTH PRINCIPLE, LLC (US) 2022-06-28 US disclosed
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
EP-3356356-B1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 FIRMENICH INCORPORATED (US) 2021-05-26 EP disclosed
US-20200377823-A1 COMPOSITIONS INCLUDING KETO-ESTER COMPOUNDS AND METHODS OF USING THE SAME TALK ABOUT IT SOLUTIONS 2020-12-03 US disclosed
EP-3728487-A2 COMPOSITIONS INCLUDING KETO-ESTER COMPOUNDS AND METHODS OF USING THE SAME Fourth Principle, LLC. (US) 2020-10-28 EP disclosed
CN-104981524-B Organopolysiloxane compositions vulcanizable at ambient temperature into elastomers and novel organopolysiloxane polycondensation catalysts 埃肯有机硅法国简易股份公司 2020-03-13 CN disclosed
US-9732071-B2 Compounds useful as modulators of TRPM8 SENOMYX, INC. (US) 2017-08-15 US disclosed
CN-105073922-B Article with antifouling properties, intended for aquatic uses and, in particular, for marine uses 蓝星有机硅法国两合公司 2017-05-17 CN disclosed
CN-105008473-B Articles having antifouling properties for water applications and in particular marine applications 蓝星有机硅法国两合公司 2017-04-19 CN disclosed
US-20170096418-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 FIRMENICH INCORPORATED 2017-04-06 US disclosed
US-20170087199-A1 COMPOSITIONS FOR DELIVERING A COOLING SENSATION SENOMYX INC (US) 2017-03-30 US disclosed
US-20160376263-A1 BITTER TASTE MODIFIERS INCLUDING SUBSTITUTED 1-BENZYL-3-(1-(ISOXAZOL-4-YLMETHYL)-1H-PYRAZOL-4-YL)IMIDAZOLIDINE-2,4-DIONES AND COMPOSITIONS THEREOF SENOMYX INC (US) 2016-12-29 US disclosed
CN-105073922-A Article with antifouling properties, intended for aquatic uses and, in particular, for marine uses BLUESTAR SILICONES FRANCE 2015-11-18 CN disclosed
CN-105008473-A Articles having antifouling properties for water applications and in particular marine applications BLUESTAR SILICONES FRANCE 2015-10-28 CN disclosed
CN-104981523-A Organopolysiloxane composition suitable for vulcanisation into an elastomer at room temperature and new organopolysiloxane polycondensation catalysts BLUESTAR SILICONES FRANCE 2015-10-14 CN disclosed
CN-104981524-A Organopolysiloxane composition suitable for vulcanisation into elastomer at room temperature and new organopolysiloxane polycondensation catalysts BLUESTAR SILICONES FRANCE 2015-10-14 CN 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-20160376263-A1 BITTER TASTE MODIFIERS INCLUDING SUBSTITUTED 1-BENZYL-3-(1-(ISOXAZOL-4-YLMETHYL)-1H-PYRAZOL-4-YL)IMIDAZOLIDINE-2,4-DIONES AND COMPOSITIONS THEREOF TAS2R5, TAS1R1, TAS2R1 TLR8 149/4885ALDH1A1 1490/4885POLB 3476/4885
US-20170087199-A1 COMPOSITIONS FOR DELIVERING A COOLING SENSATION TRPA1, PDE6G, PDE6D TLR8 416/4885ALDH1A1 1029/4885POLB 3252/4885
US-20170096418-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 TRPM8, TRPM6, TRPM4 TLR8 225/4885ALDH1A1 3880/4885POLB 4236/4885

“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.