SCHEMBL81386

SCHEMBL81386

CCOC(=O)CC(=O)c1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLOD2 O00469 2/20 0.61
PLOD3 O60568 1/20 0.55
PLOD1 Q02809 1/20 0.55
ALDH1A1 P00352 4/20 0.54
MAPT P10636 1/20 0.54
TP53 P04637 2/20 0.53
TBXAS1 P24557 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KMT2A Q03164 3/20 0.50
LMNA P02545 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
MEN1 O00255 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HPGD P15428 1/20 0.49
GAA P10253 1/20 0.49
CYP1A2 P05177 1/20 0.49

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
SCHEMBL7661524 0.93 PLOD2 (0.56) PLOD2PLOD3PLOD1ALDH1A1MAPT
SCHEMBL6158655 0.86 TBXAS1 (0.58) PLOD2PLOD3PLOD1ALDH1A1MAPT
SCHEMBL82139 0.85 PLOD2 (0.67) PLOD2PLOD3PLOD1ALDH1A1MAPT
SCHEMBL30489909 0.85 PLOD2 (0.67) PLOD2PLOD3PLOD1ALDH1A1MAPT
SCHEMBL2819978 0.85 PLOD2 (0.58) PLOD2PLOD3PLOD1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL11375570 0.85 TBXAS1 (0.57) PLOD2PLOD3PLOD1ALDH1A1MAPT
SCHEMBL13912524 0.85 ALDH1A1 (0.52) PLOD2ALDH1A1MAPTTP53TBXAS1
Hydrochloric Acid SCHEMBL6946997 0.84 PLOD2 (0.65) PLOD2PLOD3PLOD1ALDH1A1MAPT
SCHEMBL7501224 0.82 ALDH1A1 (0.50) ALDH1A1MAPTTP53TBXAS1L3MBTL1
SCHEMBL10320930 0.81 PLOD2 (0.89) PLOD2PLOD3PLOD1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307411-A Preparation method of 2-acyl naphthol compound 西北工业大学 2024-07-09 CN claimed
CN-104557738-A Green synthesis method of 4(3H)-quinazolinone UNIV HUNAN 2015-04-29 CN claimed
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
US-12378200-B2 Oxopyridine derivatives useful as aminocarboxymuconate semialdehyde decarboxylase (ACMSD) inhibitors ORSOBIO, INC. (US) 2025-08-05 US disclosed
EP-4563572-A1 PYRAZOLONE COMPOUND AND PYRAZOLONE AGENT The Noguchi Institute (JP) 2025-06-04 EP disclosed
US-20250129030-A1 PYRAZOLONE COMPOUND AND PYRAZOLONE AGENT THE NOGUCHI INSTITUTE (JP) 2025-04-24 US disclosed
US-12227507-B2 Pharmaceutical compounds PFIZER INC. (US) 2025-02-18 US disclosed
EP-4405334-B1 SORTILIN INHIBITORS SORTINA PHARMA AB (SE) 2025-02-12 EP disclosed
US-20250002460-A1 SORTILIN INHIBITORS SORTINA PHARMA AB (SE) 2025-01-02 US disclosed
EP-4405334-A1 SORTILIN INHIBITORS Sortina Pharma AB (SE) 2024-07-31 EP disclosed
EP-0123402-A2 Pyrimidine derivatives, preparation thereof and use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-31 EP disclosed
US-4478842-A THROMBOXANE SYNTHETASE INHIBITORS CIBA-GEIGY CORPORATION (US) 1984-10-23 US disclosed
US-4147552-A Light-sensitive compositions with 3-substituted coumarin compounds as spectral sensitizers EASTMAN KODAK COMPANY (US) 1979-04-03 US disclosed
US-4127583-A Preparation of 3-(pyridinyl)-2-cyclohexene-1-ones STERLING DRUG INC. (US) 1978-11-28 US disclosed
US-4111946-A Preparation of 3-(pyridinyl)-2-cyclohexen-1-ones STERLING DRUG INC. (US) 1978-09-05 US disclosed
US-4075217-A Conversion of 3-(pyridinyl)-2-cyclohexen-1-one to 3-(pyridinyl)anilines STERLING DRUG INC. (US) 1978-02-21 US disclosed
US-4026900-A 3-(Pyridinyl)-2-cyclohexen-1-ones STERLING DRUG INC. (US) 1977-05-31 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 (5 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-12378200-B2 Oxopyridine derivatives useful as aminocarboxymuconate semialdehyde decarboxylase (ACMSD) inhibitors ALDH7A1, ACMSD, AMD1 PLOD2 416/4885PLOD3 1957/4885PLOD1 496/4885
US-12227507-B2 Pharmaceutical compounds CHRNA6, GABRA6, CHRNA7 PLOD2 4766/4885PLOD3 4651/4885PLOD1 4797/4885
US-20040181058-A1 Process for preparing 3-heteroaryl-3-hydroxypropanoic acid derivatives HPD, HAAO, GRHPR PLOD2 260/4885PLOD3 702/4885PLOD1 333/4885
US-20250002460-A1 SORTILIN INHIBITORS SORT1, GRN, SCARB1 PLOD2 3460/4885PLOD3 1530/4885PLOD1 3128/4885
US-20250129030-A1 PYRAZOLONE COMPOUND AND PYRAZOLONE AGENT NPM1, PLK3, PKN2 PLOD2 2829/4885PLOD3 3863/4885PLOD1 2955/4885

“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.