SCHEMBL15042744

SCHEMBL15042744

[N-]=[N+]=Nc1ccc(C(N)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 1/20 0.52
▸ CA2 P00918 4/20 0.50
▸ CA1 P00915 3/20 0.50
▸ CA9 Q16790 2/20 0.50
▸ CA5A P35218 1/20 0.50
▸ CA5B Q9Y2D0 1/20 0.50
▸ TP53 P04637 1/20 0.50
▸ CYP51A1 Q16850 1/20 0.45
▸ SCN1A P35498 1/20 0.45
▸ SCN2A Q99250 1/20 0.45
▸ SCN3A Q9NY46 1/20 0.45
▸ PTGS2 P35354 2/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ PARP10 Q53GL7 2/20 0.43
▸ PARP4 Q9UKK3 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PARP15 Q460N3 1/20 0.43
▸ PARP14 Q460N5 1/20 0.43

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
SCHEMBL15823854 0.83 TP53 (0.50) CA2CA1CA9CA5ACA5B
SCHEMBL13882615 0.83 TP53 (0.53) CA2CA1CA9CA5ACA5B
SCHEMBL13449659 0.81 TP53 (0.52) CA2CA1CA9CA5ACA5B
SCHEMBL28083230 0.81 TP53 (0.52) CA2CA1CA9CA5ACA5B
Hydrochloric Acid SCHEMBL28856167 0.79 TP53 (0.50) CA2CA1CA9CA5ACA5B
SCHEMBL15107819 0.79 CA1 (0.46) CA2CA1CA9CA5ACA5B
SCHEMBL13653950 0.79 NOS3 (0.53) NOS1CA2CA1CA9CA5A
SCHEMBL14020632 0.79 TP53 (0.50) CA2CA1CA9CA5ACA5B
SCHEMBL28037838 0.79 TP53 (0.50) CA2CA1CA9CA5ACA5B
SCHEMBL14060112 0.79 SCN1A (0.56) CA2CA1CA9CA5ACA5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113304081-B Degradable moisturizing self-heating polyester-based dry mask 菲诗倾城(广州)生物科技有限公司 2023-08-18 — — CN claimed
CN-113318044-B Polypropylene dry nonwoven mask capable of softening dead skin 广州艾菲芭美容科技有限公司 2023-06-20 — — CN claimed
CN-119219930-A Drug-loaded macromolecules, preparation method thereof and application thereof in medicine 江苏恒瑞医药股份有限公司 2024-12-31 — — CN disclosed
CN-116068110-B Synthesis method and application of azide mass spectrometry probe 武汉大学 2024-11-22 — — CN disclosed
US-20240335548-A1 MACROMOLECULES STARPHARMA PTY LTD (AU) 2024-10-10 — — US disclosed
US-20240016946-A1 DRUG-LOADED MACROMOLECULE AND PREPARATION METHOD THEREFOR SHANGHAI SHENGDI PHARMACEUTICAL CO., LTD. (CN) 2024-01-18 — — US disclosed
CN-113304081-B Degradable moisturizing self-heating polyester-based dry mask 菲诗倾城(广州)生物科技有限公司 2023-08-18 — — CN disclosed
EP-4205767-A1 DRUG-LOADED MACROMOLECULE AND PREPARATION METHOD THEREFOR Shanghai Senhui Medicine Co., Ltd. (CN) 2023-07-05 — — EP disclosed
CN-113318044-B Polypropylene dry nonwoven mask capable of softening dead skin 广州艾菲芭美容科技有限公司 2023-06-20 — — CN disclosed
CN-116133693-A Drug-loaded macromolecule and preparation method thereof 上海森辉医药有限公司 2023-05-16 — — CN disclosed
US-20230144534-A1 CLEAVABLE TETRAZINE USED IN BIO-ORTHOGONAL DRUG ACTIVATION TAGWORKS PHARMACEUTICALS B.V. (NL) 2023-05-11 — — US disclosed
CN-103826667-B There is surface balloon catheter of polymer air bag by photoactive reaction modification and preparation method thereof 因瓦泰克股份公司 2016-12-14 — — CN disclosed
US-9289510-B2 Polymeric drug delivery conjugates and methods of making and using thereof UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2016-03-22 — — US disclosed
WO-2015163952-A1 ISATOIC ANHYDRIDE DERIVATIVES AND APPLICATIONS THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2015-10-29 — — WO disclosed
CN-103826667-A Balloon catheter with polymeric balloon having a surface modified by a photoactivation reaction and method for making INVATEC SPA 2014-05-28 — — CN disclosed
CN-103796684-A Macromolecules STARPHARMA PTY LTD 2014-05-14 — — CN disclosed
US-8709744-B2 Manufacturing process for cellular screening substratum, resultant substratum, and method and apparatus for screening CANON KABUSHIKI KAISHA (JP) 2014-04-29 — — US disclosed
US-20130156722-A1 POLYMERIC DRUG DELIVERY CONJUGATES AND METHODS OF MAKING AND USING THEREOF UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2013-06-20 — — US disclosed
EP-2560695-A1 PHOTOACTIVATED POLYMERIC MATERIAL AND ITS USE FOR THE PREPARATION OF MEDICAL DEVICES Invatec S.p.A. (IT) 2013-02-27 — — EP disclosed
WO-2011131222-A1 PHOTOACTIVATED POLYMERIC MATERIAL AND ITS USE FOR THE PREPARATION OF MEDICAL DEVICES INVATEC S.P.A. (IT) 2011-10-27 — — WO 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 (4 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-20230144534-A1 CLEAVABLE TETRAZINE USED IN BIO-ORTHOGONAL DRUG ACTIVATION KIT, TPSB2, BTD NOS1 3861/4885CA2 933/4885CA1 442/4885
US-20130156722-A1 POLYMERIC DRUG DELIVERY CONJUGATES AND METHODS OF MAKING AND USING THEREOF CD44, MMP7, MMP26 NOS1 1291/4885CA2 2646/4885CA1 617/4885
US-20240335548-A1 MACROMOLECULES BRDT, CD44, EPCAM NOS1 2895/4885CA2 1550/4885CA1 1254/4885
US-20240016946-A1 DRUG-LOADED MACROMOLECULE AND PREPARATION METHOD THEREFOR MRPL38, MRPS27, MRPS18A NOS1 2622/4885CA2 4630/4885CA1 3501/4885

“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.

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