SCHEMBL82139

SCHEMBL82139

COC(=O)CC(=O)c1cccnc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLOD2 O00469 2/20 0.67
ALDH1A1 P00352 3/20 0.64
PLOD3 O60568 1/20 0.59
PLOD1 Q02809 1/20 0.59
KMT2A Q03164 4/20 0.54
MEN1 O00255 2/20 0.54
TBXAS1 P24557 1/20 0.52
APP P05067 1/20 0.52
GAA P10253 1/20 0.52
HCAR3 P49019 1/20 0.52
HCAR2 Q8TDS4 1/20 0.52
HDAC1 Q13547 2/20 0.51
HDAC6 Q9UBN7 1/20 0.51
THRB P10828 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
F7 P08709 1/20 0.50
F3 P13726 1/20 0.50
SARM1 Q6SZW1 1/20 0.50
SIRT2 Q8IXJ6 1/20 0.50
SIRT6 Q8N6T7 1/20 0.50

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
SCHEMBL30489909 1.00 PLOD2 (0.67) PLOD2ALDH1A1PLOD3PLOD1KMT2A
Hydrochloric Acid SCHEMBL6946997 0.98 PLOD2 (0.65) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL6863607 0.87 ALDH1A1 (0.60) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL30109394 0.87 ALDH1A1 (0.60) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL81386 0.85 PLOD2 (0.61) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL10320930 0.85 PLOD2 (0.89) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL29554726 0.85 PLOD2 (0.89) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL5160958 0.84 PLOD2 (0.59) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL5158637 0.84 PLOD2 (0.59) PLOD2ALDH1A1PLOD3PLOD1KMT2A
SCHEMBL3865572 0.83 PLOD2 (0.63) PLOD2ALDH1A1PLOD3PLOD1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1405917-B1 Process for the production of 3-Heteroaryl-3-hydroxy-propionic acid derivatives by enantioselective microbial reduction SALTIGO GMBH (DE) 2013-08-14 EP claimed
US-20040181058-A1 Process for preparing 3-heteroaryl-3-hydroxypropanoic acid derivatives LANXESS DEUTSCHLAND GMBH (DE) 2004-09-16 US claimed
CN-1497048-A Method for preparing 3-heteroarylradical-3-hydroxy-propionic acid derivative 拜尔公司 2004-05-19 CN claimed
EP-1405917-A2 Process for the production of 3-Heteroaryl-3-hydroxy-propionic acid derivatives by enantioselective microbial reduction Bayer Chemicals AG (DE) 2004-04-07 EP claimed
EP-4710923-A2 INDOLE AHR INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2026-03-18 EP disclosed
EP-3612030-B1 INDOLE AHR INHIBITORS AND USES THEREOF IKENA ONCOLOGY INC (US) 2025-12-24 EP disclosed
US-20250243177-A1 sGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2025-07-31 US disclosed
US-20250122205-A1 INDOLE AHR INHIBITORS AND USES THEREOF PAHR THERAPEUTICS, INC. 2025-04-17 US disclosed
EP-3820879-B1 PHOSPHORUS-CONTAINING PRODRUGS OF GEMCITABINE CHANGCHUN CHANGCHENG PHARMACEUTICAL TECH CO LTD (CN) 2024-11-06 EP disclosed
US-12077542-B2 Indole AHR inhibitors and uses thereof Ikena Oncology, Inc. (US) 2024-09-03 US disclosed
CN-110831600-B Indole AHR inhibitors and uses thereof 医肯纳肿瘤学公司 2023-10-17 CN disclosed
CN-111491935-B Novel analogs as modulators of androgen and glucocorticoid receptors 昂科斯特拉公司 2023-08-22 CN disclosed
EP-0329360-B1 Pyridine derivatives ICI PLC (GB) 1994-08-03 EP disclosed
US-5248780-A Thromboxane inhibitors IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1993-09-28 US disclosed
US-5166213-A Antiischemic agents, cardiovascular disorders, antiasthmatics or antiinflammatory agents IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-11-24 US disclosed
US-5053415-A Antiischemic, antiinflammatory, antiarthritic agents, cardiovascular disorders IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-10-01 US disclosed
EP-0365328-A2 Pyridine derivatives ZENECA LIMITED (GB) 1990-04-25 EP disclosed
CN-1035115-A Pyridine derivate and preparation method thereof ICI PLC (GB) 1989-08-30 CN disclosed
EP-0329360-A2 Pyridine derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-08-23 EP disclosed
US-4829076-A CARDIOVASCULAR DISORDERS ALKALOIDA VEGYESZETI GYAR (HU) 1989-05-09 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 (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-20250122205-A1 INDOLE AHR INHIBITORS AND USES THEREOF AHR, ARNT, IDO1 PLOD2 1908/4885ALDH1A1 316/4885PLOD3 3099/4885
US-20040181058-A1 Process for preparing 3-heteroaryl-3-hydroxypropanoic acid derivatives HPD, HAAO, GRHPR PLOD2 260/4885ALDH1A1 195/4885PLOD3 702/4885
US-20250243177-A1 sGC STIMULATORS GUCY1A1, PTGIS, GUCY1B1 PLOD2 2344/4885ALDH1A1 1325/4885PLOD3 3491/4885
US-12077542-B2 Indole AHR inhibitors and uses thereof AHR, ARNT, IDO1 PLOD2 1908/4885ALDH1A1 316/4885PLOD3 3099/4885

“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.