SCHEMBL352298

SCHEMBL352298

N#Cc1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 5/20 0.64
ALDH1A1 P00352 1/20 0.56
HIF1A Q16665 1/20 0.56
KAT2B Q92831 1/20 0.51
MAPT P10636 4/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
CA1 P00915 1/20 0.45
MMP2 P08253 1/20 0.45
CA14 Q9ULX7 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
MAPK1 P28482 1/20 0.45
ATM Q13315 1/20 0.44
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44

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
SCHEMBL29717198 0.85 VCAM1 (0.59) VCAM1ALDH1A1HIF1AKAT2BMAPT
SCHEMBL394172 0.85 VCAM1 (0.59) VCAM1ALDH1A1HIF1AKAT2BMAPT
SCHEMBL2426169 0.85 ALDH1A1 (0.60) VCAM1ALDH1A1HIF1AMAPTKMT2A
SCHEMBL1476966 0.83 VCAM1 (0.47) VCAM1ALDH1A1HIF1AKAT2BMAPT
SCHEMBL697848 0.83 ALDH1A1 (0.58) VCAM1ALDH1A1HIF1AMAPTKMT2A
SCHEMBL4477143 0.82 VCAM1 (0.70) VCAM1KAT2BMAPTKMT2AMEN1
SCHEMBL16958110 0.81 ALDH1A1 (0.56) VCAM1ALDH1A1HIF1AMAPTKMT2A
SCHEMBL2372334 0.81 ALDH1A1 (0.56) VCAM1ALDH1A1HIF1AMAPTKMT2A
SCHEMBL8143514 0.79 VCAM1 (0.66) VCAM1KAT2BMAPTKMT2AMEN1
SCHEMBL2085369 0.79 VCAM1 (0.66) VCAM1KAT2BMAPTTDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116217490-A Benzimidazole compound, and preparation method and application thereof 中国人民解放军军事科学院军事医学研究院 2023-06-06 CN claimed
CN-110845707-B Pyrrolo-pyrrole mono-keto tetracene analogue polymer and preparation method and application thereof 中山大学 2022-09-09 CN claimed
CN-114236024-A Method for simultaneously measuring contents of 4-fluoro-3-nitrobenzonitrile and isomers thereof 江苏宝众宝达药业股份有限公司 2022-03-25 CN claimed
CN-106187904-B Propiolamido-containing 2-phenylimidazole derivative and preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2021-07-06 CN claimed
CN-109134477-B Aza-tetracene analogue of pyrrole mono-ketone, preparation method and application thereof 中山大学 2021-06-15 CN claimed
CN-112142622-A Synthesis method of 4-fluoro-3-nitrobenzonitrile 江苏宝众宝达药业有限公司 2020-12-29 CN claimed
CN-110845707-A Pyrrolo-pyrrole mono-keto tetracene analogue polymer and preparation method and application thereof 中山大学 2020-02-28 CN claimed
US-20260097034-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LTD (HK) 2026-04-09 US disclosed
US-20260035364-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2026-02-05 US disclosed
US-12485169-B2 Compounds Grey Wolf Therapeutics Limited (GB) 2025-12-02 US disclosed
US-20250353842-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORP (US) 2025-11-20 US disclosed
US-12472448-B2 Compact hydroxamate-based affinity tags for artificially tagging biological macromolecules THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2025-11-18 US disclosed
US-12466815-B2 Carboxamide compounds and uses thereof INCYTE CORPORATION (US) 2025-11-11 US disclosed
WO-2001023347-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2001-04-05 WO disclosed
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed
EP-0563001-B1 Imidazole compounds, their preparation and use NEUROSEARCH AS (DK) 1996-02-28 EP disclosed
US-5360809-A Imidazole compounds and their use as calcium channel blockers NEUROSEARCH A/S (DK) 1994-11-01 US disclosed
EP-0563001-A1 Imidazole compounds, their preparation and use NEUROSEARCH A/S (DK) 1993-09-29 EP 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 (6 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-20250353842-A1 BICYCLIC AMINE CDK12 INHIBITORS CDK12, CDK1, CDK2 VCAM1 4514/4885ALDH1A1 4341/4885HIF1A 2310/4885
US-12472448-B2 Compact hydroxamate-based affinity tags for artificially tagging biological macromolecules HLCS, AADAC, HYPK VCAM1 532/4885ALDH1A1 3867/4885HIF1A 1789/4885
US-20260097034-A1 METALLOENZYME INHIBITOR COMPOUNDS CPN1, TPP1, DPP4 VCAM1 2252/4885ALDH1A1 189/4885HIF1A 3936/4885
US-12485169-B2 Compounds SLC10A1, VHL, CFTR VCAM1 4004/4885ALDH1A1 276/4885HIF1A 1635/4885
US-20260035364-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES SCN1B, SCN2B, SCN11A VCAM1 3618/4885ALDH1A1 760/4885HIF1A 4025/4885
US-12466815-B2 Carboxamide compounds and uses thereof PCK1, PHKG2, PHKG1 VCAM1 4682/4885ALDH1A1 2561/4885HIF1A 612/4885

“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.