Cinnamonitrile

Cinnamonitrile

SCHEMBL996307

N#C/C=C\c1ccccc1

nearest known ligand 0.54

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
ENPP2 Q13822 1/20 0.52
MAOB P27338 3/20 0.50
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
NFE2L2 Q16236 2/20 0.42
CYP19A1 P11511 2/20 0.42
MAOA P21397 2/20 0.42
TRPA1 O75762 1/20 0.42
ALOX5 P09917 1/20 0.42
MAPK1 P28482 1/20 0.42
HDAC3 O15379 1/20 0.41
TNKS O95271 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 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
Cinnamonitrile SCHEMBL23933 1.00 KDM4E (0.54) KDM4EENPP2MAOBALDH1A1LMNA
Cinnamonitrile SCHEMBL23599 1.00 KDM4E (0.54) KDM4EENPP2MAOBALDH1A1LMNA
SCHEMBL11304576 0.95 KDM4E (0.55) KDM4EENPP2MAOBNFE2L2CYP19A1
Cinnamonitrile SCHEMBL27473675 0.91 KDM4E (0.62) KDM4EENPP2MAOBALDH1A1LMNA
Cinnamonitrile SCHEMBL28165460 0.91 ENPP2 (0.50) KDM4EENPP2MAOBALDH1A1LMNA
Cinnamonitrile SCHEMBL28064832 0.91 KDM4E (0.47) KDM4EENPP2MAOBALDH1A1LMNA
Anthracene SCHEMBL27746924 0.89 RELA (0.50) KDM4EENPP2MAOBALDH1A1NFE2L2
Cinnamonitrile SCHEMBL28191076 0.87 KDM4E (0.53) KDM4EENPP2MAOBALDH1A1LMNA
SCHEMBL11265587 0.86 KDM4E (0.52) KDM4EENPP2MAOBALDH1A1NFE2L2
SCHEMBL1287794 0.86 KDM4E (0.52) KDM4EENPP2MAOBALDH1A1NFE2L2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122095019-A Resin composition 2026-05-26 CN disclosed
CN-119948101-A Thermoplastic resin composition 株式会社LG化学 2025-05-06 CN disclosed
CN-119390630-A Pro-fragrance conjugates 国际香精香料公司 2025-02-07 CN disclosed
CN-115697279-B Pro-fragrance conjugates 国际香精香料公司 2024-12-17 CN disclosed
CN-116410137-A Preparation method of trifluoromethyl substituted pyrazoline compound 中国医学科学院药用植物研究所海南分所 2023-07-11 CN disclosed
EP-4161472-A1 PROFRAGRANCE CONJUGATES International Flavors & Fragrances Inc. (US) 2023-04-12 EP disclosed
CN-115697279-A Pro-fragrance conjugates 国际香精香料公司 2023-02-03 CN disclosed
US-8614081-B2 Nitrilase biocatalysts CODEXIS, INC. (US) 2013-12-24 US disclosed
US-20120142063-A1 NITRILASE BIOCATALYSTS Codexis ,Inc. (US) 2012-06-07 US disclosed
WO-2011011630-A2 NITRILASE BIOCATALYSTS CODEXIS, INC. (US) 2011-01-27 WO disclosed
US-4705807-A NERVOUS SYSTEM DISORDERS LILLY INDUSTRIES LIMITED (GB) 1987-11-10 US disclosed