SCHEMBL264866

SCHEMBL264866

CC(OC(N)=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.58
ALOX5 P09917 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP1A2 P05177 1/20 0.48
PKM P14618 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ALDH1A1 P00352 2/20 0.44
TP53 P04637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KMT2A Q03164 1/20 0.44
FFAR1 O14842 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2C P18825 1/20 0.42
LMNA P02545 1/20 0.42
HIF1A Q16665 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP3A4 P08684 1/20 0.42
SRC P12931 1/20 0.41
LPAR1 Q92633 2/20 0.41

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
SCHEMBL5956415 1.00 HCAR2 (0.58) HCAR2ALOX5CYP2D6CYP1A2PKM
SCHEMBL27820414 1.00 HCAR2 (0.58) HCAR2ALOX5CYP2D6CYP1A2PKM
SCHEMBL6478149 1.00 HCAR2 (0.58) HCAR2ALOX5CYP2D6CYP1A2PKM
Hydrochloric Acid SCHEMBL27791121 0.98 HCAR2 (0.56) HCAR2ALOX5CYP2D6CYP1A2PKM
Hydrogen Sulfide SCHEMBL27486651 0.98 HCAR2 (0.56) HCAR2ALOX5CYP2D6CYP1A2PKM
Methane SCHEMBL10711774 0.98 HCAR2 (0.56) HCAR2ALOX5CYP2D6CYP1A2PKM
SCHEMBL10520492 0.91 HCAR2 (0.50) HCAR2ALOX5CYP2D6CYP1A2PKM
Acrylic Acid SCHEMBL19712995 0.89 HCAR2 (0.57) HCAR2ALOX5CYP2D6CYP1A2PKM
SCHEMBL14856086 0.89 PTGS2 (0.55) HCAR2ALOX5CYP1A2PKMSMN1; SMN2
SCHEMBL9091695 0.86 PARP10 (0.51) HCAR2ALOX5CYP2D6SMN1; SMN2KMT2A

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 1033 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114106034-B Amino acid and preparation method and application thereof 山东达因海洋生物制药股份有限公司 2023-08-01 CN claimed
CN-113466389-B Method for obtaining levorotatory muscone by utilizing chromatographic separation technology 宏济堂制药(商河)有限公司 2023-04-07 CN claimed
CN-114047280-B Method for detecting content of non-volatile unknown substances in medical instrument leaching liquor 苏州药明康德新药开发有限公司 2022-11-08 CN claimed
CN-114106034-A Amino acid and preparation method and application thereof 山东达因海洋生物制药股份有限公司 2022-03-01 CN claimed
CN-114047280-A Method for detecting content of non-volatile unknown substances in medical instrument leaching liquor 苏州药明康德新药开发有限公司 2022-02-15 CN claimed
CN-113466389-A Method for obtaining levorotatory muscone by utilizing chromatographic separation technology 山东宏济堂制药集团股份有限公司 2021-10-01 CN claimed
CN-109096505-B Method for improving interfacial property of composite material by grafting polycarboxy polyurethane 大连理工大学 2021-04-20 CN claimed
CN-109536963-A A kind of application of carbamate compound in magnesium alloy etching additive 上海镁印科技有限公司 2019-03-29 CN claimed
CN-109096505-A A kind of polyurethane grafted method for improving composite material interface performance of more carboxyls 大连理工大学 2018-12-28 CN claimed
CN-109001326-A A kind of diclazuril enantiomer chiral chromatogram method for separating and analyzing 广州研创生物技术发展有限公司 2018-12-14 CN claimed
US-5606084-A Process of fluorinating organic compounds with 1-substituted-4-fluoro-1,4-diazoniabicyclo octane salts ALLIEDSIGNAL INC. (US) 1997-02-25 US claimed
US-5409808-A Excellent sensitivity and gradation; improved storage stability FUJI PHOTO FILM CO., LTD. (JP) 1995-04-25 US claimed
EP-0253372-B1 1,2,3,3a,8,8a-Hexahydro-1,3a,8-trimethylpyrrolo[2,3-b]indoles, a process for their preparation and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1994-09-28 EP claimed
US-4933285-A Multiple monolayers of polymeric linkages on a solid phase for immobilizing macromolecules ENVIRONMENTAL TECHNOLOGIES GROUP, INC. (US) 1990-06-12 US claimed
US-4892858-A Heat sensitive transfer materials FUJI PHOTO FILM CO., LTD. (JP) 1990-01-09 US claimed
EP-0253372-A2 1,2,3,3a,8,8a-Hexahydro-1,3a,8-trimethylpyrrolo[2,3-b]indoles, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-01-20 EP claimed
EP-0241703-A2 Optical waveguides and methods for making same GTE LABORATORIES INCORPORATED (US) 1987-10-21 EP claimed
EP-0050746-B1 PROCESS OF PRINTING BY IMPACT AND FOR MARKING AREAS WHERE IMPACT OR PRESSURE IS APPLIED ALLIED CORPORATION (US) 1985-06-05 EP claimed
EP-0050746-A2 Process of printing by impact and for marking areas where impact or pressure is applied ALLIED CORPORATION (US) 1982-05-05 EP claimed
US-4328259-A CARBONLESS COPY PAPER, POLYMERIZATION OF ACETYLENIC MONOMERS ALLIED CORPORATION (US) 1982-05-04 US claimed