SCHEMBL1029152

SCHEMBL1029152

Cc1ccccc1N(C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.50
SIGMAR1 Q99720 1/20 0.49
ALDH1A1 P00352 1/20 0.47
HSD17B1 P14061 11/20 0.46
HSD17B2 P37059 10/20 0.46
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.43

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
Benzene SCHEMBL28335658 1.00 TRPM8 (0.50) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Cyclohexane SCHEMBL28333261 0.94 LMNA (0.47) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Toluene SCHEMBL28335771 0.94 HSD17B1 (0.50) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Butane SCHEMBL28335758 0.92 TRPM8 (0.49) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Hexane SCHEMBL28333356 0.89 ALDH1A1 (0.52) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Pentane SCHEMBL28488550 0.89 ALDH1A1 (0.49) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Decane SCHEMBL28489733 0.88 ALDH1A1 (0.55) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Octane SCHEMBL28482856 0.88 ALDH1A1 (0.55) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Undecane SCHEMBL28333290 0.88 ALDH1A1 (0.55) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2
Heptane SCHEMBL28333266 0.88 ALDH1A1 (0.55) TRPM8SIGMAR1ALDH1A1HSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3877365-A1 SUBSTITUTED TOLYL AS FUNGICIDES FMC CORPORATION (US) 2021-09-15 EP claimed
CN-110028607-A A kind of synthetic method of stereoregular polymethacrylamide 哈尔滨工程大学 2019-07-19 CN claimed
CN-109085255-A A kind of method HPLC method analysis and prepare 3- (N- p-toluenesulfonyl-L- alanyl oxygroup) -5- phenylpyrrole and its enantiomter 长春百纯和成医药科技有限公司 2018-12-25 CN claimed
CN-108956808-A A kind of method that the vertical lactone enantiomter of biacetyl section was analyzed and prepared to HPLC method 长春百纯和成医药科技有限公司 2018-12-07 CN claimed
CN-104058991-B Novel Process For The Preparation Of Amino Acid Derivatives 优时比制药有限公司 2017-04-12 CN claimed
US-20250320314-A1 CHITOSAN COMPOUNDS AND OPTICAL ISOMER SEPARATING AGENT DAICEL CORPORATION (JP) 2025-10-16 US disclosed
US-12281104-B2 Process for the production of ethyl 3-amino-1-[(3R,4S)-4-cyanotetrahydropyran-3-yl]pyrazole-4-carboxylate through chiral separation of a racemic mixture INTERVET INC. (US) 2025-04-22 US disclosed
CN-117538434-A Detection method of nilaparib intermediate 苏州正济医药研究有限公司 2024-02-09 CN disclosed
CN-117538435-A Method for detecting nebivolol intermediate isomer 苏州正济医药研究有限公司 2024-02-09 CN disclosed
CN-116751148-A Isomer compound for inhibiting weed seed germination and seedling growth and application thereof 青海省农林科学院 2023-09-15 CN disclosed
US-20220220226-A1 CHITOSAN COMPOUNDS AND OPTICAL ISOMER SEPARATING AGENT DAICEL CORPORATION (JP) 2022-07-14 US disclosed
US-20220204483-A1 Process for the Production of Ethyl 3-Amino-1-[(3R,4S)-4-Cyanotetrahydropyran-3-YL]pyrazole-4-Carboxylate Through Chiral Separation of a Racemic Mixture INTERVET INC. (US) 2022-06-30 US disclosed
US-5017290-A Chromatography DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
EP-0190466-B1 PROCESS FOR THE PRODUCTION OF N-METHYLCARBAMATES ENICHEM SYNTHESIS S.p.A. (IT) 1990-11-28 EP disclosed
US-4966694-A CELLULOSE TRI-BETA-NAPHTHOATE; OPTICAL RESOLUTIONS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1990-10-30 US disclosed
US-4879038-A Separation agent comprising acyl- or carbamoyl-substituted polysaccharide DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-11-07 US disclosed
US-4659845-A Process for the production of N-methylcarbamates ENICHEM SINTESI S.P.A. (IT) 1987-04-21 US disclosed
US-4624870-A AMMONIUM HYDROXIDE-STABILIZED COLLOIDAL SILICA, ORGANOTRIALKOXYSILANE CONDENSATE GENERAL ELECTRIC COMPANY (US) 1986-11-25 US disclosed
US-4258200-A REACTION OF FATTY ACID ESTERS AND AMINES AIR PRODUCTS AND CHEMICALS, INC. (US) 1981-03-24 US disclosed
US-4251667-A Process for the preparation of aromatic urethanes ATLANTIC RICHFIELD COMPANY (US) 1981-02-17 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 (2 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-12281104-B2 Process for the production of ethyl 3-amino-1-[(3R,4S)-4-cyanotetrahydropyran-3-yl]pyrazole-4-carboxylate through chiral separation of a racemic mixture CYP3A4, CYP4B1, ACMSD TRPM8 4780/4885SIGMAR1 1200/4885ALDH1A1 457/4885
US-20220204483-A1 Process for the Production of Ethyl 3-Amino-1-[(3R,4S)-4-Cyanotetrahydropyran-3-YL]pyrazole-4-Carboxylate Through Chiral Separation of a Racemic Mixture CYP3A4, CYP4B1, ACMSD TRPM8 4780/4885SIGMAR1 1200/4885ALDH1A1 457/4885

“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.