SCHEMBL2690899

SCHEMBL2690899

CC(C)CC(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.55
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
MMP9 P14780 1/20 0.43
MMP13 P45452 1/20 0.43
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.38
CA7 P43166 1/20 0.38
CYP2C19 P33261 1/20 0.35
CTSK P43235 1/20 0.35
MLYCD O95822 2/20 0.35

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
Hydrazine SCHEMBL27371027 0.95 CYP2D6 (0.51) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL96701 0.83 CYP2D6 (0.49) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL607503 0.83 CYP2D6 (0.53) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL5468494 0.83 CYP2D6 (0.53) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL1260631 0.83 CYP2D6 (0.53) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL14073854 0.83 MMP1 (0.42) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL12297016 0.82 CYP2D6 (0.45) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL20921978 0.82 CYP2D6 (0.45) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL22774942 0.81 MMP1 (0.41) CYP2D6HDAC3HDAC1HDAC2HDAC8
SCHEMBL21811455 0.81 CYP2D6 (0.47) CYP2D6HDAC3HDAC1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110981873-B Preparation method for synthesizing pyrroloquinoline quinone by five-step method 江西农业大学 2025-01-24 CN claimed
CN-119213579-A Electrolyte composition for lithium ion battery cells having anodes comprising a blend of silicon-carbon composite particles and graphite particles 新罗纳米技术有限公司 2024-12-27 CN claimed
CN-117466825-A Preparation method of Ai Nuowei Lin Zhongjian body 南京艾迪医药科技有限公司 2024-01-30 CN claimed
WO-2023177892-A1 ELECTROLYTE COMPOSITIONS FOR LITHIUM-ION BATTERY CELLS WITH ANODES COMPRISING A BLEND OF SILICON- CARBON COMPOSITE PARTICLES AND GRAPHITE PARTICLES SILA NANOTECHNOLOGIES, INC. (US) 2023-09-21 WO claimed
US-20230299362-A1 ELECTROLYTE COMPOSITIONS FOR LITHIUM-ION BATTERY CELLS WITH ANODES COMPRISING A BLEND OF SILICON-CARBON COMPOSITE PARTICLES AND GRAPHITE PARTICLES SILA NANOTECHNOLOGIES, INC. 2023-09-21 US claimed
CN-111807936-B Preparation method of prenyl isopentenyl ether 万华化学集团股份有限公司 2022-11-08 CN claimed
WO-2021057014-A1 KLUYVEROMYCES MARXIANUS ALDO-KETO REDUCTASE KMAKR MUTANT AND APPLICATION THEREOF 浙江工业大学 2021-04-01 WO claimed
CN-111807936-A Preparation method of prenyl isopentenyl ether 万华化学集团股份有限公司 2020-10-23 CN claimed
EP-3088955-B1 RESIST COMPOSITION AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2020-06-03 EP claimed
CN-111171884-A Valerate gasoline mixed fuel 中国科学院兰州化学物理研究所 2020-05-19 CN claimed
US-20160139512-A1 PATTERN FORMING PROCESS AND SHRINK AGENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-05-19 US claimed
US-20160124312-A1 PATTERN FORMING PROCESS AND SHRINK AGENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-05-05 US claimed
US-20160124313-A1 PATTERN FORMING PROCESS AND SHRINK AGENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-05-05 US claimed
CN-102471553-B Fluorine-containing copolymer composition and method for producing same ASAHI GLASS CO.,LTD. (JP) 2016-02-10 CN claimed
EP-2976339-A1 GEMINALLY SUBSTITUTED CYANOETHYLPYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2016-01-27 EP claimed
US-20150338744-A1 PATTERN FORMING PROCESS AND SHRINK AGENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-11-26 US claimed
US-9052603-B2 Pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-06-09 US claimed
US-20150086929-A1 PATTERN FORMING PROCESS AND SHRINK AGENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-03-26 US claimed
WO-2014146491-A1 GEMINALLY SUBSTITUTED CYANOETHYLPYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-09-25 WO claimed
US-20140234785-A1 PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-08-21 US claimed