SCHEMBL656043

SCHEMBL656043

CC(C)(C)OC(=O)Nc1cccc(N)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
DDX3X O00571 2/20 0.59
HDAC3 O15379 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CYP17A1 P05093 1/20 0.49
PTGS1 P23219 3/20 0.49
RXFP1 Q9HBX9 1/20 0.48
SYK P43405 1/20 0.47
MAPT P10636 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
CA1 P00915 2/20 0.46

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
SCHEMBL29478358 1.00 ALDH1A1 (0.60) ALDH1A1DDX3XHDAC3HDAC1HDAC2
SCHEMBL18391079 0.95 ALDH1A1 (0.54) ALDH1A1DDX3XHDAC3HDAC1HDAC2
SCHEMBL29008615 0.94 ALDH1A1 (0.54) ALDH1A1DDX3XHDAC3HDAC1HDAC2
SCHEMBL3786374 0.91 CYP17A1 (0.57) ALDH1A1DDX3XHDAC3HDAC1HDAC2
SCHEMBL15648062 0.89 NAMPT (0.62) ALDH1A1DDX3XHDAC3HDAC8HDAC6
SCHEMBL29029431 0.88 HDAC3 (0.56) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL13622713 0.87 AURKA (0.48) ALDH1A1DDX3XHDAC3HDAC1HDAC2
SCHEMBL13622966 0.87 PTGS1 (0.55) ALDH1A1HDAC3HDAC1HDAC2HDAC8
SCHEMBL13622710 0.87 ALDH1A1 (0.47) ALDH1A1DDX3XHDAC3HDAC1HDAC2
SCHEMBL3780607 0.86 CYP17A1 (0.49) ALDH1A1DDX3XHDAC3HDAC1HDAC2

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 1161 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115286583-B Diphenylamino pyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor 山东大学 2024-01-30 CN claimed
CN-113461636-B Benzothiazole-containing phenylalanine derivative and preparation method and application thereof 山东大学 2023-08-08 CN claimed
CN-115286583-A Diphenylaminopyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor 山东大学 2022-11-04 CN claimed
CN-113461636-A Benzothiazole-containing phenylalanine derivative and preparation method and application thereof 山东大学 2021-10-01 CN claimed
CN-107930412-B Preparation method of acid-resistant poly (amide-triazine-amine) nanofiltration composite membrane 浙江大学 2020-01-14 CN claimed
CN-107930412-A A kind of anti-acid gathers(Acid amides atrazin)The preparation method of Nano filtering composite membrane 浙江大学 2018-04-20 CN claimed
CN-106243044-A Pyridine derivatives containing halo acrylamide side chain and preparation and application 浙江大学 2016-12-21 CN claimed
US-12637467-B2 Inhibitor of BTK and mutants thereof NEWAVE PHARMACEUTICAL INC. (US) 2026-05-26 US disclosed
CN-122059950-A Compounds with proteasome agonistic activity, preparation method and application thereof 浙大城市学院 2026-05-19 CN disclosed
US-12583862-B2 Bifunctional compounds for degrading BTK via ubiquitin proteosome pathway NURIX THERAPEUTICS, INC. (US) 2026-03-24 US disclosed
CN-121673187-A Diamine monomer containing amide structure, polyamide-imide, and preparation method and application thereof 天津科技大学 2026-03-17 CN disclosed
US-20260071223-A1 LIPID CONJUGATES FOR THE DELIVERY OF THERAPEUTIC AGENTS TO ADIPOSE TISSUE ARROWHEAD PHARMACEUTICALS INC (US) 2026-03-12 US disclosed
US-20260035378-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BTK VIA UBIQUITIN PROTEOSOME PATHWAY NURIX THERAPEUTICS INC (US) 2026-02-05 US disclosed
EP-0672037-B1 1,4-BENZODIAZEPINE DERIVATIVES AND THEIR USE AS CCK-MODULATORS GLAXO GROUP LTD (GB) 1998-07-08 EP disclosed
US-5770736-A DIAZONIUM-, AZIDO-, OR AZOCARBOXYLATE-DERIVATIZED POLYPHENYLENE AMIDATE COMPOUNDS NORTHEASTERN UNIVERSITY (US) 1998-06-23 US disclosed
US-5760032-A GASTROINTESTINAL DISORDERS AND NERVOUS SYSTEM DISORDERS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-06-02 US disclosed
EP-0776892-A1 THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-06-04 EP disclosed
EP-0672037-A1 1,4-BENZODIAZEPINE DERIVATIVES AND THEIR USE AS CCK-MODULATORS GLAXO GROUP LIMITED (GB) 1995-09-20 EP disclosed
CN-1093085-A Sulfonamide derivatives GLAXO GROUP LTD (GB) 1994-10-05 CN disclosed
WO-1994013648-A1 1,4-BENZODIAZEPINE DERIVATIVES AND THEIR USE AS CCK-MODULATORS GLAXO GROUP LIMITED (GB) 1994-06-23 WO 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-20260071223-A1 LIPID CONJUGATES FOR THE DELIVERY OF THERAPEUTIC AGENTS TO ADIPOSE TISSUE FABP4, PLIN1, PLIN3 ALDH1A1 1769/4885DDX3X 1229/4885HDAC3 773/4885
US-12637467-B2 Inhibitor of BTK and mutants thereof BTK, CNKSR1, SYK ALDH1A1 4481/4885DDX3X 3260/4885HDAC3 1118/4885
US-20260035378-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BTK VIA UBIQUITIN PROTEOSOME PATHWAY BTK, PSMB2, PSMB1 ALDH1A1 4621/4885DDX3X 1995/4885HDAC3 843/4885
US-12583862-B2 Bifunctional compounds for degrading BTK via ubiquitin proteosome pathway BTK, PSMB2, PSME3 ALDH1A1 4714/4885DDX3X 1320/4885HDAC3 628/4885

“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.