SCHEMBL4967290

SCHEMBL4967290

CC(C)(C)OC(=O)NCCCC(N)=O

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.68
MAOB P27338 1/20 0.68
TDP1 Q9NUW8 1/20 0.62
MEN1 O00255 1/20 0.59
GAA P10253 1/20 0.59
KMT2A Q03164 1/20 0.59
CA1 P00915 10/20 0.51
CA2 P00918 10/20 0.51
CA12 O43570 6/20 0.51
CA9 Q16790 6/20 0.51
EPHX1 P07099 1/20 0.44
HTT P42858 1/20 0.43
STK17B O94768 1/20 0.43
STK17A Q9UEE5 1/20 0.43
CAPN1 P07384 1/20 0.43
SIGMAR1 Q99720 1/20 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
SCHEMBL963880 0.94 MAOA (0.71) MAOAMAOBTDP1MEN1GAA
SCHEMBL31747379 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL22511877 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL7977069 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL1930913 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL31169526 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL19243360 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL1328306 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL31169524 0.93 MAOA (0.73) MAOAMAOBTDP1MEN1GAA
SCHEMBL608970 0.90 MAOA (0.60) MAOAMAOBTDP1MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023121022-A1 NOVEL LEUKOTRIENE B4 RECEPTOR INHIBITORS AND USE THEREOF 이화여자대학교 산학협력단 2023-06-29 WO claimed
CN-102798710-B Alkaline red G detection kit and preparation method thereof GUANGZHOU QUALITY SUPERVISION INSPECTION RES INST 2014-08-27 CN claimed
CN-102798710-A Alkaline red G detection kit and preparation method thereof GUANGZHOU QUALITY SUPERVISION INSPECTION RES INST 2012-11-28 CN claimed
EP-3794002-B1 COMPOUNDS ENTERPRISE THERAPEUTICS LTD (GB) 2023-08-02 EP disclosed
WO-2022272133-A2 PROTEIN STABILIZING COMPOUNDS CONTAINING USP7 LIGANDS Stablix, Inc. (US) 2022-12-29 WO disclosed
US-20220242905-A1 MODIFIED PEPTIDES AND THEIR USE CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2022-08-04 US disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
EP-3612525-B1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES INC (US) 2021-10-27 EP disclosed
EP-3856758-A1 MODIFIED PEPTIDES AND THEIR USE UNIVERSITE DE MONTPELLIER (FR) 2021-08-04 EP disclosed
WO-2021143680-A1 HETEROARYL DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 浙江海正药业股份有限公司 2021-07-22 WO disclosed
EP-3544981-B1 BENZODIAZOLIUM COMPOUNDS AS ENAC INHIBITORS ENTERPRISE THERAPEUTICS LTD (GB) 2021-06-23 EP disclosed
US-20100261710-A1 HDAC Inhibitors ARQULE, INC. (US) 2010-10-14 US disclosed
WO-2008016643-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-02-07 WO disclosed
EP-1303528-A1 ADENOSINE COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 2003-04-23 EP disclosed
WO-2002004474-A1 ADENOSINE COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME NIKKEN CHEMICALS CO. LTD. (JP) 2002-01-17 WO disclosed
US-6329502-B1 VIRICIDES AGAINST HUMAN IMMUNODEFICIENCY VIRUS; TREATMENT OF AIDS (ACQUIRED IMMUNE DEFICIENCY SYNDROME) JAPAN ENERGY CORPORATION (JP) 2001-12-11 US disclosed
US-6313094-B1 COMPOSITION FOR INHIBITING HUMAN IMMUNODEFICIENCY VIRUS REPLICATION JAPAN ENERGY CORPORATION (JP) 2001-11-06 US disclosed
EP-0490667-B1 HIV protease inhibitors JAPAN ENERGY CORP (JP) 1999-06-09 EP disclosed
US-5397796-A Inhibitors of platelet aggregation, metastasis of carcinoma cells and osteoclast binding to the bone surfaces CASSELLA AG (DE) 1995-03-14 US disclosed
EP-0490667-A2 HIV protease inhibitors JAPAN ENERGY CORPORATION (JP) 1992-06-17 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 (2 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-20100261710-A1 HDAC Inhibitors HDAC5, HDAC1, HDAC4 MAOA 1679/4885MAOB 2099/4885TDP1 1200/4885
US-20220242905-A1 MODIFIED PEPTIDES AND THEIR USE NGLY1, VIP, NPPA MAOA 4523/4885MAOB 4554/4885TDP1 4600/4885

“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.