SCHEMBL2694778

SCHEMBL2694778

O=C(O)CC(=O)c1cccnc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLOD2 O00469 3/20 0.79
▸ PLOD3 O60568 2/20 0.65
▸ PLOD1 Q02809 2/20 0.65
▸ ALDH1A1 P00352 4/20 0.62
▸ APP P05067 1/20 0.62
▸ GAA P10253 1/20 0.62
▸ HCAR3 P49019 1/20 0.62
▸ HCAR2 Q8TDS4 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ HDAC1 Q13547 2/20 0.56
▸ HDAC6 Q9UBN7 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ HDAC8 Q9BY41 1/20 0.55
▸ F7 P08709 1/20 0.55
▸ F3 P13726 1/20 0.55
▸ SARM1 Q6SZW1 1/20 0.55
▸ SIRT2 Q8IXJ6 1/20 0.55
▸ SIRT6 Q8N6T7 1/20 0.55
▸ SIRT1 Q96EB6 1/20 0.55
▸ SIRT3 Q9NTG7 1/20 0.55

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
SCHEMBL14110105 0.91 PLOD2 (0.72) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL10320930 0.90 PLOD2 (0.89) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL29554726 0.90 PLOD2 (0.89) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL4625207 0.89 PLOD2 (1.00) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL30440488 0.89 PLOD2 (1.00) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL9466134 0.84 PLOD2 (0.68) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL6611633 0.83 PLOD2 (0.71) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL30489910 0.83 PLOD2 (0.71) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL29450185 0.83 PLOD2 (0.66) PLOD2PLOD3PLOD1ALDH1A1APP
SCHEMBL5158150 0.83 PLOD2 (0.71) PLOD2PLOD3PLOD1ALDH1A1APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8334381-B2 Process for the preparation of intermediates useful in the synthesis of imatinib F.I.S. FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2012-12-18 — — US claimed
US-20100234598-A1 PROCESS FOR THE PREPARATION OF IMATINIB AND INTERMEDIATES THEREOF FALCHI ALESSANDRO 2010-09-16 — — US claimed
EP-2074095-A2 PROCESS FOR THE PREPARATION OF IMATINIB AND INTERMEDIATES THEREOF F.I.S. Fabbrica Italiana Sintetici S.p.A. (IT) 2009-07-01 — — EP claimed
WO-2008059551-A2 PROCESS FOR THE PREPARATION OF IMATINIB AND INTERMEDIATES THEREOF F.I.S. FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2008-05-22 — — WO claimed
WO-2007053773-A1 COMPOSITIONS AND METHODS USING NICOTINIC ACID FOR TREATMENT OF HYPERCHOLESTEROLEMIA, HYPERLIPIDEMIA AND CARDIOVASCULAR DISEASE HENDRIX CURT (US) 2007-05-10 — — WO claimed
US-20070105793-A1 Compositions and methods using nicotinic acid for treatment of hypercholesterolemia, hyperlipidemia nd cardiovascular disease CONCOURSE HEALTH SCIENCES LLC 2007-05-10 — — US claimed
WO-2001014310-A1 PLEUROMUTILIN β-KETOESTERS SMITHKLINE BEECHAM P.L.C. (GB) 2001-03-01 — — WO claimed
EP-4631931-A1 HDAC INHIBITOR AND USE THEREOF Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2025-10-15 — — EP disclosed
CN-118772048-A HDAC inhibitor and application thereof 微境生物医药科技(上海)有限公司 2024-10-15 — — CN disclosed
CN-107021951-A SGC stimulators 铁木医药有限公司 2017-08-08 — — CN disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 — — US disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 — — US disclosed
CN-103313976-B sGC stimulators 铁木医药有限公司 2016-11-23 — — CN disclosed
US-5410057-A 1-heteroarylazetidines and -pyrrolidines SANOFI (FR) 1995-04-25 — — US disclosed
EP-0333080-B1 BETA-CARBONYL-CARBOXYAMIDES OF 1,3-THIAZOLIDINES BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-10-13 — — EP disclosed
US-5206254-A Antitussive agents BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-04-27 — — US disclosed
EP-0407403-A1 BETA-CARBONYL-CARBOXYAMIDES OF 1,3-THIAZOLIDINES BOEHRINGER BIOCHEMIA ROBIN S.p.A. (IT) 1991-01-16 — — EP disclosed
WO-1989008648-A1 beta-CARBONYL-CARBOXYAMIDES OF 1,3-THIAZOLIDINES BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) 1989-09-21 — — WO disclosed
EP-0333080-A1 Beta-carbonyl-carboxyamides of 1,3-thiazolidines BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1989-09-20 — — EP disclosed
US-4710508-A ANALGESICS WARNER-LAMBERT COMPANY (US) 1987-12-01 — — 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 (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-20100234598-A1 PROCESS FOR THE PREPARATION OF IMATINIB AND INTERMEDIATES THEREOF ABL1, PDGFRA, ABL2 PLOD2 3351/4885PLOD3 4322/4885PLOD1 3567/4885

“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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