SCHEMBL25373752

SCHEMBL25373752

N#CC(C(=O)O)=C(N)c1cccnc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.63
F7 P08709 1/20 0.61
F3 P13726 1/20 0.61
SARM1 Q6SZW1 1/20 0.61
SIRT2 Q8IXJ6 1/20 0.61
SIRT6 Q8N6T7 1/20 0.61
SIRT1 Q96EB6 1/20 0.61
SIRT3 Q9NTG7 1/20 0.61
SIRT5 Q9NXA8 1/20 0.61
SIRT4 Q9Y6E7 1/20 0.61
ALDH1A1 P00352 5/20 0.53
APP P05067 1/20 0.53
GAA P10253 1/20 0.53
HCAR3 P49019 1/20 0.53
HCAR2 Q8TDS4 1/20 0.53
PLOD2 O00469 1/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
MAPT P10636 1/20 0.43
CYP1A1 P04798 1/20 0.42

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
SCHEMBL123932 0.83 ALDH1A1 (0.47) POLBALDH1A1GAAMAPTCYP3A4
SCHEMBL123933 0.83 ALDH1A1 (0.47) POLBALDH1A1GAAMAPTCYP3A4
SCHEMBL123931 0.83 ALDH1A1 (0.47) POLBALDH1A1GAAMAPTCYP3A4
Niacinamide SCHEMBL4601203 0.79 F7 (0.88) POLBF7F3SARM1SIRT2
SCHEMBL28507362 0.79 POLB (0.52) POLBF7F3SARM1SIRT2
Niacinamide SCHEMBL4730414 0.79 F7 (0.96) POLBF7F3SARM1SIRT2
Niacinamide SCHEMBL675207 0.79 F7 (0.96) POLBF7F3SARM1SIRT2
Niacinamide SCHEMBL11483547 0.77 F7 (0.92) POLBF7F3SARM1SIRT2
Niacinamide SCHEMBL28157721 0.77 F7 (0.92) POLBF7F3SARM1SIRT2
SCHEMBL2928423 0.77 POLB (0.62) POLBF7F3SARM1SIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109867623-B 3-pyridyl-3-amino-2-cyanoacrylate compounds and preparation method and application thereof 江苏省农药研究所股份有限公司 2021-02-09 CN claimed
CN-119431188-A 2-Cyano-3-disubstituted phenyl acrylate compound, preparation method thereof and application thereof in pesticides 江苏省中国科学院植物研究所 2025-02-14 CN disclosed
US-20240298639-A1 2-CYANOACRYLATE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CO., LTD. (CN) 2024-09-12 US disclosed
EP-4238958-A1 2-CYANOACRYLATE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Zhejiang University (CN) 2023-09-06 EP disclosed
CN-109867623-B 3-pyridyl-3-amino-2-cyanoacrylate compounds and preparation method and application thereof 江苏省农药研究所股份有限公司 2021-02-09 CN disclosed
CN-109867623-B 3-pyridyl-3-amino-2-cyanoacrylate compounds and preparation method and application thereof 江苏省农药研究所股份有限公司 2021-02-09 CN disclosed
CN-109867623-B 3-pyridyl-3-amino-2-cyanoacrylate compounds and preparation method and application thereof 江苏省农药研究所股份有限公司 2021-02-09 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240298639-A1 2-CYANOACRYLATE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP51A1, FAR1, CYP4F11 POLB 4386/4885F7 594/4885F3 1379/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.