SCHEMBL20653

SCHEMBL20653

COC(=O)/C=C/c1ccc(C=O)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.72
CA1 P00915 3/20 0.72
CA2 P00918 3/20 0.72
CA7 P43166 3/20 0.72
CA9 Q16790 3/20 0.72
CA14 Q9ULX7 3/20 0.72
TYR P14679 1/20 0.72
PTPN1 P18031 1/20 0.62
TTR P02766 1/20 0.61
APP P05067 1/20 0.61
KMT2A Q03164 1/20 0.59
EPHX2 P34913 1/20 0.56
ALDH1A1 P00352 4/20 0.55
KDM4E B2RXH2 3/20 0.54
MAPT P10636 2/20 0.54
JAK2 O60674 1/20 0.54
GAA P10253 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
FDPS P14324 1/20 0.51

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
SCHEMBL20654 1.00 CA12 (0.72) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL724881 0.98 CA12 (0.70) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL724882 0.98 CA12 (0.70) CA12CA1CA2CA7CA9
SCHEMBL71224 0.92 CA12 (0.84) CA12CA1CA2CA7CA9
SCHEMBL5057418 0.92 CA12 (0.84) CA12CA1CA2CA7CA9
E-Methyl Cinnamate SCHEMBL5487325 0.91 KMT2A (0.68) CA12CA1CA2CA7CA9
E-Methyl Cinnamate SCHEMBL5487323 0.91 KMT2A (0.68) CA12CA1CA2CA7CA9
SCHEMBL4429179 0.90 ALDH1A1 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4429187 0.90 ALDH1A1 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4429182 0.88 ALDH1A1 (0.62) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109232541-B Prolyl hydroxylase and histone deacetylase dual inhibitor and preparation method and application thereof 中国医学科学院放射医学研究所 2020-04-24 CN claimed
WO-2018092151-A1 PROCESS FOR THE PREPARATION OF 2-(E)-N-HYDROXY-3-[4-[[[2-(2-METHYL-1H-INDOL-3-YL) ETHYL]AMINO]METHYL]PHENYL]-2-PROPENAMIDE 2-HYDROXYPROPANOIC ACID (1:1) AND ITS POLYMORPHS THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2018-05-24 WO claimed
CN-106674079-A Synthesis method of panobinostat 南京卡文迪许生物工程技术有限公司 2017-05-17 CN claimed
EP-2394991-B1 Process for making starting materials for N-hydroxy-3-[4-[2-(2-methyl-1 H-indol-3-yl)-ethylaminomethyl]-phenyl]-2E-2-propenamide NOVARTIS AG (CH) 2015-09-23 EP claimed
US-8536346-B2 Process or making N-hydroxy-3[4-[[[2-(2methyl-1H-indol-3-yl)ethyl]amino]methyl]phenyl]-2E-2-propenamide and starting materials therefor NOVARTIS AG (CH) 2013-09-17 US claimed
US-20120010418-A1 Process for Making N-Hydroxy-3[4-[[[2-(2methyl-1H-indol-3-yl)ethyl]amino]methyl]phenyl]-2E-2-propenamide and Starting Materials Therefor NOVARTIS AG (CH) 2012-01-12 US claimed
EP-2394991-A1 Process for making n-hydroxy-3-ü4-üüü2-(2-methyl-1h-indol-3-yl)ethyl¨amino¨methyl¨phenyl¨-2e-2-propenamide and starting materials therefor Novartis AG (CH) 2011-12-14 EP claimed
US-20090306405-A1 PROCESS FOR MAKING N-HYDROXY-3-[4-[[[2-(2-METHYL-1H-INDOL-3-YL)ETHYL]AMINO]METHYL]PHENYL]-2E-2-PROPENAMIDE AND STARTING MATERIALS THEREFOR NOVARTIS AG (CH) 2009-12-10 US claimed
EP-2032533-A2 PROCESS FOR MAKING N-HYDROXY-3-Ý4-ÝÝÝ2-(2-METHYL-1H-INDOL-3-YL)ETHYL¨AMINO¨METHYL¨PHENYL¨-2E-2-PROPENAMIDE AND STARTING MATERIALS THEREFOR Novartis AG (CH) 2009-03-11 EP claimed
WO-2007146718-A2 PROCESS FOR MAKING N-HYDROXY-3-[4-[[[2-(2-METHYL-1H-INDOL-3-YL)ETHYL]AMINO] METHYL]PHENYL]-2E-2-PROPENAMIDE AND STARTING MATERIALS THEREFOR NOVARTIS AG (CH) 2007-12-21 WO claimed
US-12491270-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography THE GENERAL HOSPITAL CORPORATION (US) 2025-12-09 US disclosed
US-12479797-B2 Cyclopropyl-amide compounds as dual LSD1/HDAC inhibitors Jubilant Epicore LLC (US) 2025-11-25 US disclosed
US-20250346563-A1 HISTONE DEACETYLASE 6 INHIBITORS AND METHOD FOR TREATING NEUROPATHIC PAIN UNIV TAIPEI MEDICAL (TW) 2025-11-13 US disclosed
EP-3455204-B1 CYCLOPROPYL-AMIDE COMPOUNDS AS DUAL LSD1/HDAC INHIBITORS Jubilant Epicore LLC (US) 2025-10-29 EP disclosed
US-20250304549-A1 HYDROXYAMIDE DERIVATIVE AND USE THEREOF SICHUAN HUIYU PHARMACEUTICAL CO., LTD. (CN) 2025-10-02 US disclosed
US-4346016-A FOR NATURAL AND SYNTHETIC POLYMERS CIBA-GEIGY CORPORATION (US) 1982-08-24 US disclosed
US-4309443-A ANTI-OBESITY, HYPOGLYCEMIC BEECHAM GROUP LIMITED (GB) 1982-01-05 US disclosed
EP-0025331-A1 Cinnamic acid derivatives, their preparation, and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1981-03-18 EP disclosed
US-4196229-A NITRILES, ESTERS, AMIDES, SULFONES, AND KETONES SANDOZ LTD. (CH) 1980-04-01 US disclosed
US-4108887-A Divinyl stilbenes as optical brighteners SANDOZ LTD. (CH) 1978-08-22 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 (6 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-12491270-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 CA12 317/4885CA1 195/4885CA2 2377/4885
US-20250346563-A1 HISTONE DEACETYLASE 6 INHIBITORS AND METHOD FOR TREATING NEUROPATHIC PAIN HDAC1, HDAC3, HDAC5 CA12 1559/4885CA1 479/4885CA2 719/4885
US-12479797-B2 Cyclopropyl-amide compounds as dual LSD1/HDAC inhibitors HDAC1, HDAC11, HDAC2 CA12 3079/4885CA1 1041/4885CA2 1873/4885
US-20090306405-A1 PROCESS FOR MAKING N-HYDROXY-3-[4-[[[2-(2-METHYL-1H-INDOL-3-YL)ETHYL]AMINO]METHYL]PHENYL]-2E-2-PROPENAMIDE AND STARTING MATERIALS THEREFOR WEE2, WEE1, HASPIN CA12 4432/4885CA1 4177/4885CA2 4107/4885
US-20250304549-A1 HYDROXYAMIDE DERIVATIVE AND USE THEREOF HDAC1, HDAC11, HDAC5 CA12 1730/4885CA1 740/4885CA2 942/4885
US-20120010418-A1 Process for Making N-Hydroxy-3[4-[[[2-(2methyl-1H-indol-3-yl)ethyl]amino]methyl]phenyl]-2E-2-propenamide and Starting Materials Therefor PNMT, HTR1B, WEE2 CA12 4009/4885CA1 3594/4885CA2 3453/4885

“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.