SCHEMBL1041731

SCHEMBL1041731

CC(C)(C)OC(=O)NCCCCCCBr

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.71
MAOA P21397 1/20 0.61
MAOB P27338 1/20 0.61
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
GAA P10253 1/20 0.57
CA12 O43570 6/20 0.56
CA1 P00915 6/20 0.56
CA2 P00918 6/20 0.56
CA9 Q16790 6/20 0.56
EPHX1 P07099 2/20 0.44
CYP3A4 P08684 1/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
DRD2 P14416 4/20 0.42

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
SCHEMBL21596987 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL6449941 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL7292779 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL17286185 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL1149061 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL19460948 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL26634879 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL18604607 1.00 TDP1 (0.71) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL229087 0.98 TDP1 (0.68) TDP1MAOAMAOBMEN1KMT2A
SCHEMBL7434 0.92 TDP1 (0.65) TDP1MAOAMAOBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121574086-B Dicyano-isophorone derivative, preparation method thereof and application of dicyano-isophorone derivative as near infrared fluorescent probe for detecting COX-2 BINZHOU MEDICAL UNIVERSITY (CN) 2026-05-26 CN claimed
CN-121574086-A Dicyano-isophorone derivative, preparation method thereof and application of dicyano-isophorone derivative as near infrared fluorescent probe for detecting COX-2 滨州医学院 2026-02-27 CN claimed
CN-117417521-A Amphiphilic polymer, polymer micelle, preparation method and application thereof 华侨大学 2024-01-19 CN claimed
CN-102161688-A Cholesterol-structure-fragment-containing biocompatible synthesis liposomes as well as preparation method and application thereof SHANGHAI INST ORGANIC CHEM 2011-08-24 CN claimed
CN-121574086-B Dicyano-isophorone derivative, preparation method thereof and application of dicyano-isophorone derivative as near infrared fluorescent probe for detecting COX-2 BINZHOU MEDICAL UNIVERSITY (CN) 2026-05-26 CN disclosed
WO-2026107406-A1 p53 HETEROBIFUNCTIONAL CONJUGATES AND USES THEREOF Design Therapeutics, Inc. (US) 2026-05-21 WO disclosed
CN-122057036-A Hypoxia-targeted hyaluronic acid nano delivery system and construction method and application thereof 上海健康医学院 2026-05-19 CN disclosed
US-20260132133-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC (US) 2026-05-14 US disclosed
EP-4151622-B1 AROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF IN DRUG SICHUAN ACAD OF MEDICAL SCIENCES SICHUAN PROVINCIAL PEOPLES HOSPITAL (CN) 2026-05-06 EP disclosed
US-12616753-B2 HSP70 inhibitors and methods of using same THE WISTAR INSTITUTE (US) 2026-05-05 US disclosed
US-20260109732-A1 LIPID AMINES MODERNATX INC (US) 2026-04-23 US disclosed
US-20260108618-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS CIDARA THERAPEUTICS, INC. 2026-04-23 US disclosed
US-5292756-A Novel sulfonamide fibrinogen receptor antagonists MERCK & CO., INC. (US) 1994-03-08 US disclosed
WO-1993019046-A1 NOVEL SULFONAMIDE FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1993-09-30 WO disclosed
US-5217994-A METHOD OF INHIBITING OSTEOCLAST-MEDIATED BONE RESORPTION BY ADMINISTRATION OF AMINOALKYL-SUBSTITUTED PHENYL DERIVATIVES MERCK & CO., INC. (US) 1993-06-08 US disclosed
US-5204350-A Treating osteoporosis MERCK & CO., INC. (US) 1993-04-20 US disclosed
EP-0528587-A1 Inhibiting osteoclast-mediated bone resorption using substituted phenyl derivatives MERCK & CO. INC. (US) 1993-02-24 EP disclosed
EP-0528586-A1 Inhibiting osteoclast-mediated bone resorption using aminoalkyl-substituted phenyl derivatives MERCK & CO. INC. (US) 1993-02-24 EP disclosed
EP-0478328-A1 Novel fibrinogen receptor antagonists MERCK & CO. INC. (US) 1992-04-01 EP disclosed
EP-0478363-A2 Novel sulfonamide fibrinogen receptor antagonists MERCK & CO. INC. (US) 1992-04-01 EP 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-20260132133-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF KRAS, HRAS, BCL6 TDP1 2369/4885MAOA 4845/4885MAOB 4731/4885
US-12616753-B2 HSP70 inhibitors and methods of using same HSPB1, HSP90AB1, HSF1 TDP1 846/4885MAOA 3211/4885MAOB 3094/4885
US-20260108618-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS FCGR3B, FCGR1A, FCGR2A TDP1 3694/4885MAOA 1115/4885MAOB 1349/4885
US-20260109732-A1 LIPID AMINES LDLR, NPC1, PHOSPHO1 TDP1 3880/4885MAOA 1793/4885MAOB 1873/4885

“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.