SCHEMBL167038

SCHEMBL167038

CCC=C(C#N)C(=O)OCC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.62
ALDH1A1 P00352 7/20 0.52
TSHR P16473 1/20 0.52
MAPT P10636 7/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
PTP4A1 Q93096 1/20 0.49
MIF P14174 1/20 0.49
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
USP2 O75604 2/20 0.48
GAA P10253 2/20 0.48
PDCD1 Q15116 1/20 0.47
CD274 Q9NZQ7 1/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL11269373 1.00 CYP2C9 (0.62) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL27647334 0.87 ALDH1A1 (0.57) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL2755215 0.85 CYP2C9 (0.69) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL4906704 0.85 CYP2C9 (0.69) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL4961560 0.85 CYP2C9 (0.69) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL24755221 0.85 CYP2C9 (0.46) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL8569025 0.85 CYP2C9 (0.59) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL28305233 0.85 CYP2C9 (0.59) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL7188731 0.84 CYP2C9 (0.62) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL7188735 0.84 CYP2C9 (0.62) CYP2C9ALDH1A1TSHRMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063472-A Imidazo [3,4-d ] pyrimidine compound and synthetic method and application thereof 河北大学 2024-05-24 CN claimed
CN-117976996-A Battery, preparation method thereof and electricity utilization device 江苏正力新能电池技术有限公司 2024-05-03 CN claimed
CN-117447703-A Multifunctional group modified silane compound and preparation method thereof, hardening coating and preparation method thereof 深圳市华星光电半导体显示技术有限公司 2024-01-26 CN claimed
CN-115215767-B Process for preparing 2-cyano-3-ethoxyacrylic acid ethyl ester derivative 帕潘纳(北京)科技有限公司 2023-09-12 CN claimed
CN-116355144-A Preparation method of composite functional polycarboxylate superplasticizer 南京师范大学 2023-06-30 CN claimed
CN-115215767-A Process for preparing 2-cyano-3-ethoxy ethyl acrylate derivatives 帕潘纳(北京)科技有限公司 2022-10-21 CN claimed
CN-111276738-B Asymmetric solid electrolyte, preparation method thereof and application thereof in high-voltage solid-state battery 中国科学院化学研究所 2021-08-31 CN claimed
CN-111276738-A Asymmetric solid electrolyte, preparation method thereof and application thereof in high-voltage solid-state battery 中国科学院化学研究所 2020-06-12 CN claimed
CN-105079856-B A kind of cyanoacrylate medical adhesive and its production and use 沈伟 2017-12-01 CN claimed
CN-106752988-A A kind of strong adherence Metal adhesive and preparation method thereof 山东禹王和天下新材料有限公司 2017-05-31 CN claimed
CN-104399113-A Adhesive for soft tissues and preparation method of adhesive SUZHOU BEC BIOLOGICAL TECHNOLOGY CO LTD 2015-03-11 CN claimed
CN-103747811-A Protective wound dressing device for oral and pharyngeal space ETHICON INC 2014-04-23 CN claimed
CN-101967115-B Synthesis and herbicidal activity of 3-substituted phenoxybenzamine-2-cyanoacrylate ethoxyethyl compound UNIV NANKAI 2013-09-18 CN claimed
CN-102775328-A Environment-friendly preparation method of alpha-cyanoacrylate compound BEIJING COMPONT MEDICAL DEVICES CO LTD 2012-11-14 CN claimed
CN-102101833-A Preparation method of alpha-cyanoacrylate FUSHUN GELIAHAO CHEMICAL CO LTD 2011-06-22 CN claimed
CN-101967115-A Synthesis and herbicidal activity of 3-substituted phenoxybenzamine-2-cyanoacrylate ethoxyethyl compound UNIV NANKAI 2011-02-09 CN claimed
CN-1239653-C Cyanoacrylate compositions, reaction products, methods of preparation and uses thereof LOCTITE R & D LTD (IE) 2006-02-01 CN claimed
CN-1692951-A Medical adhesive used for adhering skin and viscus hemostasis, and its prepn. method SHI PING AN (CN) 2005-11-09 CN claimed
CN-1660068-A Application of ethoxy ethyl ester alpha-cyanoacrylate in preparing adhesive of medical use for treating hernia and binding skin tissue SHI PING AN (CN) 2005-08-31 CN claimed
CN-1487983-A Cyanoacrylate compositions curable to flexible polymeric materials ���̩��(R&D)���޹�˾ 2004-04-07 CN claimed