SCHEMBL78063

SCHEMBL78063

[CH2]NC(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.61
HDAC3 O15379 1/20 0.61
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
IDO1 P14902 1/20 0.61
HDAC1 Q13547 1/20 0.61
CA9 Q16790 1/20 0.61
HDAC7 Q8WUI4 1/20 0.61
HDAC2 Q92769 1/20 0.61
HSD17B10 Q99714 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
NCOR2 Q9Y618 1/20 0.61
GAA P10253 2/20 0.56
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
CTDSP1 Q9GZU7 1/20 0.52
PTGS2 P35354 1/20 0.52
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 4/20 0.50

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
SCHEMBL2176500 0.82 TSHR (0.60) ALOX15CA12CA1CA9KMT2A
SCHEMBL6972053 0.81 RAB9A (0.62) ALOX15HDAC3CA12CA1IDO1
SCHEMBL301050 0.81 TRPA1 (0.62) ALOX15HDAC3CA12CA1IDO1
SCHEMBL76489 0.78 ALDH1A1 (0.67) ALOX15HDAC3CA12CA1IDO1
SCHEMBL400890 0.78 RAB9A (0.77) ALOX15HDAC3CA12CA1IDO1
SCHEMBL8192752 0.78 ALOX15 (0.67) ALOX15HDAC3CA12CA1IDO1
SCHEMBL12324391 0.76 RAB9A (0.82) ALOX15HDAC3CA12CA1IDO1
SCHEMBL21755109 0.76 HDAC8 (1.00) ALOX15HDAC3CA12CA1IDO1
Benzohydroxamate SCHEMBL28895973 0.76 HDAC8 (1.00) ALOX15HDAC3CA12CA1IDO1
Benzohydroxamate SCHEMBL133061 0.76 HDAC8 (1.00) ALOX15HDAC3CA12CA1IDO1

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 1512 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4380998-A2 METHOD OF SYNTHESIZING A MUCIN AND PRODUCT THEREOF Research Foundation Of The City University Of New York (US) 2024-06-12 EP claimed
CN-117999269-A Improved process for producing cyclic guanosine monophosphate analogues 米雷卡医药有限公司 2024-05-07 CN claimed
WO-2024068520-A1 3-(HETERO)ARYL-5-CHLORODIFLUOROMETHYL-1,2,4-OXADIAZOLE AS FUNGICIDE BAYER AKTIENGESELLSCHAFT (DE) 2024-04-04 WO claimed
CN-113444092-B Preparation and medical application of ring-containing Renieramycin G derivatives 中国医学科学院药物研究所 2024-02-06 CN claimed
WO-2023014875-A2 METHOD OF SYNTHESIZING A MUCIN AND PRODUCT THEREOF RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) 2023-02-09 WO claimed
CN-113444092-A Preparation and medical application of Renieramycin G derivative containing middle ring 中国医学科学院药物研究所 2021-09-28 CN claimed
EP-2800756-B1 PEPTIDE C ALPHA-AMIDES, METHODS FOR PREPARING SAME AND USES THEREOF AS PRECURSORS OF PEPTIDE C ALPHA-THIOESTERS FOR PROTEIN SYNTHESIS CENTRE NAT RECH SCIENT (FR) 2018-04-25 EP claimed
CN-107617393-A A kind of phosgene reactor for carbon tetrachloride processing equipment 徐州工程学院 2018-01-23 CN claimed
EP-2462141-B1 NOVEL AZAHETEROCYCLIC COMPOUNDS MERCK PATENT GMBH (DE) 2017-09-27 EP claimed
EP-2220048-B1 ARYL- AND HETEROARYLCARBONYL DERIVATIVES OF BENZOMORPHANES AND RELATED SCAFFOLDS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE BOEHRINGER INGELHEIM INT (DE) 2017-01-25 EP claimed
EP-0071370-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them ICI PHARMA (FR) 1983-02-09 EP claimed
EP-0008058-B1 N-AMINO-3,4,5-TRIHYDROXYPIPERIDINES, METHODS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM, METHOD FOR THE PRODUCTION OF THE MEDICAMENTS AND ANIMAL FEEDSTUFF CONTAINING SAID COMPOUNDS BAYER AG (DE) 1982-08-18 EP claimed
EP-0055562-A2 Cephalosporin derivatives ICI PHARMA (FR) 1982-07-07 EP claimed
EP-0055099-A1 Penicillin derivatives ICI PHARMA (FR) 1982-06-30 EP claimed
EP-0053017-A1 Amide derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-06-02 EP claimed
EP-0045161-A1 Amides of 4-oxo-5-amidohexanoic acid derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-02-03 EP claimed
EP-0039903-A2 8-Substituted pyrrolizidines and quaternary ammonium salts thereof SUNTORY KABUSHIKI KAISHA (JP) 1981-11-18 EP claimed
US-4293551-A N-Amino-3,4,5-trihydroxypiperidines, their production and their medicinal use BAYER AKTIENGESELLSCHAFT (DE) 1981-10-06 US claimed
EP-0008058-A1 N-Amino-3,4,5-trihydroxypiperidines, methods for their preparation, medicaments containing them, method for the production of the medicaments and animal feedstuff containing said compounds BAYER AG (DE) 1980-02-20 EP claimed
US-RE30149-E OXIDATION OF 4-AMINOMETHYL-CYCLOHEXANE METHANOL AB KABI (SE) 1979-11-13 US claimed