SCHEMBL2009003

SCHEMBL2009003

O=C(O)COc1cccnc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.62
NOTUM Q6P988 1/20 0.56
NAMPT P43490 1/20 0.53
CHRNB2 P17787 4/20 0.50
CHRNA4 P43681 4/20 0.50
LMNA P02545 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
MAPT P10636 1/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA4 P22748 1/20 0.48
CA9 Q16790 1/20 0.48
CCNC P24863 1/20 0.48
CDK8 P49336 1/20 0.48
PTPN7 P35236 1/20 0.47
FFAR1 O14842 1/20 0.47
PTPN1 P18031 1/20 0.47

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
Hydrochloric Acid SCHEMBL6067927 0.98 ALOX15 (0.60) ALOX15NOTUMNAMPTCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL29642862 0.98 ALOX15 (0.60) ALOX15NOTUMNAMPTCHRNB2CHRNA4
Trifluoroacetic Acid SCHEMBL2413465 0.91 ALOX15 (0.51) ALOX15NOTUMNAMPTCHRNB2CHRNA4
SCHEMBL10669859 0.84 CYP4F2 (0.51) NOTUMCHRNB2CHRNA4
SCHEMBL30588953 0.84 MAPT (0.52) NOTUMNAMPTCHRNB2CHRNA4MAPT
SCHEMBL13113159 0.84 CHRNB2 (0.53) NOTUMNAMPTCHRNB2CHRNA4MAPT
SCHEMBL1814097 0.84 MAPT (0.52) NOTUMNAMPTCHRNB2CHRNA4MAPT
SCHEMBL2394585 0.83 PLOD2 (0.58) NOTUMNAMPTLMNAMAPT
SCHEMBL15517627 0.82 KMO (0.55) ALOX15NOTUMLMNACA12CA1
SCHEMBL15429528 0.82 CHRNB2 (0.56) CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3704094-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-11 EP disclosed
WO-2025098432-A1 mIDH1/NAMPT DUAL-TARGET INHIBITOR AND USE THEREOF 中国药科大学 2025-05-15 WO disclosed
CN-117510484-B MIDH1/NAMPT double-target inhibitor and application thereof 中国药科大学 2024-11-22 CN disclosed
US-20240166652-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-05-23 US disclosed
CN-117510484-A mIDH1/NAMPT double-target inhibitor and application thereof 中国药科大学 2024-02-06 CN disclosed
CN-116589402-A Compound serving as NAMPT-PDE delta double-target inhibitor and application thereof 中国人民解放军海军军医大学 2023-08-15 CN disclosed
US-20230014907-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED 2023-01-19 US disclosed
WO-2021252849-A1 INHIBITORS OF APOL1 AND USE OF THE SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2021-12-16 WO disclosed
US-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. 2021-06-17 US disclosed
US-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-19 US disclosed
US-5691323-A BENZIMIDAZOL-2-ONES MERCK & CO., INC. (US) 1997-11-25 US disclosed
US-5644028-A Process for producing peptide derivatives and salts therefor JAPAN ENERGY CORPORATION (JP) 1997-07-01 US disclosed
US-5574044-A BENZIMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF MYOPIA MERCK & CO., INC. (US) 1996-11-12 US disclosed
WO-1996013262-A1 MUSCARINE ANTAGONISTS MERCK & CO., INC. (US) 1996-05-09 WO disclosed
EP-0574135-A1 Process for producing peptide derivatives and salts thereof JAPAN ENERGY CORPORATION (JP) 1993-12-15 EP disclosed
US-4937268-A TREATMENT OF ASTHMA, CHRONIC BRONCHITIS GLAXO GROUP LIMITED (GB) 1990-06-26 US disclosed
EP-0286242-A2 Ethanolamine derivates, processes for their preparation and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1988-10-12 EP disclosed
US-4524071-A HISTAMINE H2-ANTAGONISTS GLAXO GROUP LIMITED (GB) 1985-06-18 US disclosed
US-4404020-A Certain esters of 2-[(2,6-dichloro-3-pyridyl)oxy]propionic acid, compositions containing same and their herbicidal properties CIBA-GEIGY CORPORATION (US) 1983-09-13 US disclosed
EP-0074229-A1 Triazole gastric anti-secretory agents PFIZER INC. (US) 1983-03-16 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 (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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ALOX15 639/4885NOTUM 4143/4885NAMPT 2047/4885
US-20230014907-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME APOL1, APOB, NPC1L1 ALOX15 164/4885NOTUM 350/4885NAMPT 2118/4885
US-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 ALOX15 2301/4885NOTUM 1324/4885NAMPT 1121/4885
US-20240166652-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ALOX15 639/4885NOTUM 4143/4885NAMPT 2047/4885

“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.