SCHEMBL16091554

SCHEMBL16091554

CC(C)(C)OC(=O)N[C@H]1CC[C@@H](Nc2ncccn2)CC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ BTK Q06187 5/20 0.47
▸ EPHX2 P34913 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ CKS1B P61024 1/20 0.46
▸ SKP1 P63208 1/20 0.46
▸ SKP2 Q13309 1/20 0.46
▸ DRD2 P14416 3/20 0.45
▸ JAK1 P23458 3/20 0.44
▸ JAK2 O60674 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ DRD3 P35462 1/20 0.43
▸ MERTK Q12866 1/20 0.43
▸ TYK2 P29597 1/20 0.43
▸ JAK3 P52333 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL21522398 0.85 KDM1A (0.53) KDM1AMAOBBTKEPHX2CKS1B
SCHEMBL22570115 0.85 MERTK (0.45) KDM1AMAOBBTKCKS1BSKP1
SCHEMBL22570099 0.85 KDM1A (0.53) KDM1AMAOBBTKEPHX2CKS1B
SCHEMBL25042174 0.85 MERTK (0.45) KDM1AMAOBBTKCKS1BSKP1
SCHEMBL28483806 0.85 MERTK (0.45) KDM1AMAOBBTKCKS1BSKP1
SCHEMBL24220939 0.83 MERTK (0.48) KDM1AMAOBBTKCKS1BSKP1
SCHEMBL29361761 0.83 MERTK (0.48) KDM1AMAOBBTKCKS1BSKP1
SCHEMBL6458263 0.82 JAK1 (0.43) KDM1AMAOBBTKEPHX2CKS1B
SCHEMBL6458275 0.82 JAK1 (0.43) KDM1AMAOBBTKEPHX2CKS1B
SCHEMBL6460800 0.81 JAK2 (0.45) KDM1AMAOBBTKCKS1BSKP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12251387-B2 Substituted quinoxalines and benzo[c][1,2,5]oxadiazoles as DNA-PK inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-03-18 — — US disclosed
EP-3740479-B1 DNA-PK INHIBITORS VERTEX PHARMA (US) 2024-11-20 — — EP disclosed
US-12121524-B2 DNA-PK inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-10-22 — — US disclosed
US-11813267-B2 DNA-PK inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-11-14 — — US disclosed
US-11813267-B2 DNA-PK inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-11-14 — — US disclosed
US-20230277547-A1 SUBSTITUTED QUINOXALINE DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-09-07 — — US disclosed
US-20230277547-A1 SUBSTITUTED QUINOXALINE DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-09-07 — — US disclosed
EP-3985003-B1 DNA-PK INHIBITORS VERTEX PHARMA (US) 2023-08-09 — — EP disclosed
EP-3985003-B1 DNA-PK INHIBITORS VERTEX PHARMA (US) 2023-08-09 — — EP disclosed
EP-3985003-A1 DNA-PK INHIBITORS Vertex Pharmaceuticals Incorporated (US) 2022-04-20 — — EP disclosed
WO-2019143675-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-07-25 — — WO disclosed
US-10258627-B2 DNA-PK inhibitors VERTEX PHARMACEUTICAL INCORPORATED (US) 2019-04-16 — — US disclosed
US-20180161336-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-06-14 — — US disclosed
US-9987284-B2 Substituted benzooxadiazole DNA-PK inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-06-05 — — US disclosed
US-20160354381-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-12-08 — — US disclosed
US-20160340341-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-11-24 — — US disclosed
US-9359380-B2 DNA-PK inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-06-07 — — US disclosed
US-9340557-B2 Substituted quinoxaline DNA-PK inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-05-17 — — US disclosed
WO-2014159690-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-10-02 — — WO disclosed
US-20140275024-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-09-18 — — 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 (9 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-20230277547-A1 SUBSTITUTED QUINOXALINE DNA-PK INHIBITORS DTYMK, POLK, TOP1 KDM1A 828/4885MAOB 1852/4885BTK 940/4885
US-11813267-B2 DNA-PK inhibitors POLK, DTYMK, DCK KDM1A 1124/4885MAOB 2973/4885BTK 916/4885
US-12121524-B2 DNA-PK inhibitors POLK, DTYMK, DCK KDM1A 1125/4885MAOB 3026/4885BTK 929/4885
US-20180161336-A1 DNA-PK INHIBITORS POLK, DTYMK, DCK KDM1A 1124/4885MAOB 2973/4885BTK 916/4885
US-20160340341-A1 DNA-PK INHIBITORS POLK, DTYMK, DCK KDM1A 1124/4885MAOB 2973/4885BTK 916/4885
US-20140275024-A1 DNA-PK INHIBITORS POLK, DTYMK, DCK KDM1A 1124/4885MAOB 2973/4885BTK 916/4885
US-12251387-B2 Substituted quinoxalines and benzo[c][1,2,5]oxadiazoles as DNA-PK inhibitors TOP1, TOP2A, TOP2B KDM1A 457/4885MAOB 977/4885BTK 615/4885
US-20160354381-A1 DNA-PK INHIBITORS POLK, DTYMK, DCK KDM1A 1124/4885MAOB 2973/4885BTK 916/4885
US-10258627-B2 DNA-PK inhibitors POLK, DTYMK, DCK KDM1A 1124/4885MAOB 2973/4885BTK 916/4885

“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.

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