SCHEMBL403269

SCHEMBL403269

N=c1ccc2ccccc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.54
▸ CA1 P00915 2/20 0.54
▸ CA4 P22748 2/20 0.54
▸ CA6 P23280 2/20 0.54
▸ CA12 O43570 1/20 0.54
▸ CA3 P07451 1/20 0.54
▸ CA5A P35218 1/20 0.54
▸ CA7 P43166 1/20 0.54
▸ CA9 Q16790 1/20 0.54
▸ CA13 Q8N1Q1 1/20 0.54
▸ CA14 Q9ULX7 1/20 0.54
▸ CA5B Q9Y2D0 1/20 0.54
▸ AOC3 Q16853 2/20 0.43
▸ CA2 P00918 2/20 0.42
▸ TRPA1 O75762 1/20 0.42
▸ ITGB2 P05107 1/20 0.42
▸ ICAM1 P05362 1/20 0.42
▸ ITGAL P20701 1/20 0.42
▸ AHR P35869 1/20 0.42
▸ ADK P55263 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
SCHEMBL29597557 1.00 ALDH1A1 (0.54) ALDH1A1CA1CA4CA6CA12
SCHEMBL28901253 0.98 ALDH1A1 (0.52) ALDH1A1CA1CA4CA6CA12
Formic Acid SCHEMBL11192981 0.88 CA1 (0.48) ALDH1A1CA1CA4CA6CA12
SCHEMBL29197198 0.80 ALDH1A1 (0.38) ALDH1A1CA1CA4CA6CA12
SCHEMBL28678145 0.79 ALDH1A1 (0.37) ALDH1A1CA1CA4CA6CA12
SCHEMBL29152421 0.70 ALDH1A1 (0.54) ALDH1A1CA1CA4CA6CA12
SCHEMBL29351086 0.70 CA12 (1.00) ALDH1A1CA1CA4CA6CA12
SCHEMBL8621 0.70 CA12 (1.00) ALDH1A1CA1CA4CA6CA12
SCHEMBL30958273 0.70 CA12 (1.00) ALDH1A1CA1CA4CA6CA12
SCHEMBL89002 0.70 ALDH1A1 (1.00) ALDH1A1CA1CA4CA6CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114349796-B Cationic metal complex iridium-iminoquinoline crystal material and preparation method thereof 江苏大学 2024-03-22 — — CN claimed
CN-114989137-B Chiral imine-containing quinoline imidazoline compound and metal complex thereof, preparation method and application 浙江大学 2024-03-01 — — CN claimed
CN-117466891-A Preparation method of 2-fluoropyrazolo [1,5-a ] pyridine compound 西北师范大学 2024-01-30 — — CN claimed
CN-113880822-B Chiral imine quinoline oxazoline-containing compound and metal complex thereof, preparation method and application 浙江大学 2023-09-19 — — CN claimed
CN-115516313-A Activity-based mass spectrometry of host cell proteins 瑞泽恩制药公司 2022-12-23 — — CN claimed
CN-114349796-A Cationic metal complex iridium-iminoquinoline crystal material and preparation method thereof 江苏大学 2022-04-15 — — CN claimed
CN-110396116-A Ketone-imidazoline -2- imine ligand [N, O] bidentate nickel, palladium complex and the preparation method and application thereof UNIV NATIONAL DONG HWA 2019-11-01 — — CN claimed
CN-106866527-B A kind of synthetic method of quinoline -2- imine derivative 北京大学 2019-09-06 — — CN claimed
CN-106866527-A A kind of synthetic method of the imine derivative of quinoline 2 北京大学 2017-06-20 — — CN claimed
US-20110061179-A1 BLUE POLYMERIC HAIR DYES BASF SE (US) 2011-03-17 — — US claimed
EP-2238205-A1 BLUE POLYMERIC HAIR DYES BASF SE (DE) 2010-10-13 — — EP claimed
WO-2009090124-A1 BLUE POLYMERIC HAIR DYES BASF SE (DE) 2009-07-23 — — WO claimed
EP-4701782-A1 CATALYST SYSTEM AND ETHYLENE OLIGOMERIZATION PROCESS FOR THE PREPARATION OF LINEAR ALPHA OLEFINS Chevron Phillips Chemical Company LP (US) 2026-03-04 — — EP disclosed
EP-4701783-A1 PHOSPHINE-IMINO-QUINOLINE AND RELATED LIGANDS FOR USE IN ETHYLENE OLIGOMERIZATION PROCESSES Chevron Phillips Chemical Company LP (US) 2026-03-04 — — EP disclosed
CN-121013762-A Phosphine-imino-quinolines and related ligands for use in ethylene oligomerization processes 切弗朗菲利浦化学公司 2025-11-25 — — CN disclosed
US-20250346619-A1 Phosphino-Quinoline-Pyridine Ligands and Methods CHEVRON PHILLIPS CHEMICAL CO LP (US) 2025-11-13 — — US disclosed
EP-0724570-A1 AMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1996-08-07 — — EP disclosed
CN-1123275-A Substituted quinoline derivatives, method for the production thereof and use thereof HOECHST AG (DE) 1996-05-29 — — CN disclosed
CN-1083477-A 4-imino-quinoline, its preparation method and application thereof HOECHST AG (DE) 1994-03-09 — — CN disclosed
US-4077960-A YELLOW, POLYMERS TEIJIN LIMITED (JA) 1978-03-07 — — US 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 (2 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-20250346619-A1 Phosphino-Quinoline-Pyridine Ligands and Methods PHOSPHO1, PEBP1, PNPO ALDH1A1 4445/4885CA1 2126/4885CA4 2342/4885
US-20110061179-A1 BLUE POLYMERIC HAIR DYES CUTA, IK, TYR ALDH1A1 2076/4885CA1 4063/4885CA4 1813/4885

“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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