SCHEMBL101140

SCHEMBL101140

NC(CO)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.50
SCN4A P35499 2/20 0.50
F2 P00734 1/20 0.50
HTR2A P28223 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
GRIN3A Q8TCU5 1/20 0.45
TRPA1 O75762 2/20 0.45
ADRA2A P08913 1/20 0.44
ADRA2C P18825 1/20 0.44

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
SCHEMBL176645 1.00 DPP4 (0.50) DPP4SCN4AF2HTR2ATAAR1
SCHEMBL30559582 1.00 DPP4 (0.50) DPP4SCN4AF2HTR2ATAAR1
SCHEMBL101141 1.00 DPP4 (0.50) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL20972918 0.97 SCN4A (0.48) DPP4SCN4AF2HTR2ATAAR1
Ammonia Solution, Strong SCHEMBL13737655 0.97 SCN4A (0.48) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL19554902 0.97 SCN4A (0.48) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL30450135 0.95 GRIN2D (0.47) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL30450281 0.95 GRIN2D (0.47) DPP4SCN4AF2HTR2ATAAR1
Isopropyl Alcohol SCHEMBL4065314 0.91 KDM4E (0.54) TAAR1TRPA1ADRA2AADRA2C
Phenol SCHEMBL28231638 0.91 CA12 (0.48) DPP4SCN4AF2GRIN2DGRIN3B

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

Appears in 6040 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025133248-A1 DIASTEREOMERIC AMINOALCOHOL AND AMINOETHER SALTS OF 2-[(4R,S)-8-FLUORO-2-[4-(3-METHOXYPHENYL)PIPERAZIN-1-YL]-3-[2-METHOXY-5-(TRIFLUOROMETHYL)PHENYL]-3,4-DIHYDROQUINAZOLIN-4-YL]ACETIC ACID AND THEIR USE FOR ENANTIOMERIC SEPARATION AIC246 AG & CO. KG (DE) 2025-06-26 WO claimed
CN-119656869-A Method for realizing diastereomeric crystallization mother liquor regeneration and reuse of amine chiral compound by utilizing unconventional electrodialysis 湖南科技大学 2025-03-21 CN claimed
WO-2024259837-A1 METHOD FOR SYNTHESIZING INDIGO AND DERIVATIVES THEREOF BY MEANS OF DUAL-ENZYME CASCADE CATALYSIS 南京工业大学 2024-12-26 WO claimed
CN-119110654-A Method for constructing artificial vision system based on cluster heterojunction and application 中国科学院化学研究所 2024-12-10 CN claimed
CN-118184650-A 6- (1H-pyrrolo [2,3-b ] pyridin-3-yl) quinazoline-4-amine derivative, and preparation method and application thereof 中国人民解放军北部战区总医院 2024-06-14 CN claimed
US-20240052394-A1 BIOPRODUCTION OF ENANTIOPURE (R)- AND (S)-2-PHENYLGLYCINOL FROM STYRENE AND RENEWABLE FEEDSTOCKS VIA ARTIFICIAL ENZYME CASCADE NATIONAL UNIVERSITY OF SINGAPORE (SG) 2024-02-15 US claimed
CN-117538301-A Method for recognizing amino alcohol chirality by utilizing room temperature phosphorescence 中国科学技术大学 2024-02-09 CN claimed
CN-115626891-B Synthesis method of nilaparib key intermediate 四川轻化工大学 2024-01-26 CN claimed
CN-115028624-B Quinoxaline skeleton NN oxazoline ligand and synthetic method and application thereof 上海师范大学 2023-10-27 CN claimed
CN-116829726-A Biological production of enantiomerically pure (R) -and (S) -2-phenylglycinol from styrene and renewable raw materials by artificial enzyme cascade 新加坡国立大学 2023-09-29 CN claimed
EP-0175278-A2 Optical isomer of triazolylpentenols, and their production and use as fungicide herbicide and/or plant growth regulant SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-03-26 EP claimed
EP-0121284-A2 (+)-Triazolylpentenol derivative, its production and use as herbicide and/or plant growth regulant SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-10-10 EP claimed
US-4355045-A Anti-inflammatory 1-phenylethanolamine derivatives pharmaceutical compositions thereof and processes for their manufacture IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-10-19 US claimed
EP-0054431-A1 Optical isomer of a triazolylpentenol, and its production and use as fungicide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-23 EP claimed
EP-0000809-B1 ANTI-INFLAMMATORY 1-PHENYLETHANOLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF AND PROCESSES FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-04-14 EP claimed
EP-0006298-A1 Anti-inflammatory 1-phenyl-2-aminoethanol derivatives, pharmaceutical compositions thereof for topical use, and processes for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-01-09 EP claimed
EP-0000809-A1 Anti-inflammatory 1-phenylethanolamine derivatives, pharmaceutical compositions thereof and processes for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-02-21 EP claimed
US-4097389-A DETERGENTS FOR LUBRICANTS AND FUELS MOBIL OIL CORPORATION (US) 1978-06-27 US claimed
US-4008186-A Novel fire-retardant polymer THE DOW CHEMICAL COMPANY (US) 1977-02-15 US claimed
US-4001149-A Novel fire-retardant polymer THE DOW CHEMICAL COMPANY (US) 1977-01-04 US claimed