SCHEMBL3929271

SCHEMBL3929271

CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CO

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
OPRD1 P41143 1/20 0.50
NAMPT P43490 3/20 0.48
NR1D1 P20393 1/20 0.44
PRMT5 O14744 3/20 0.43
WDR77 Q9BQA1 3/20 0.43
MAPK1 P28482 1/20 0.43
BCL2 P10415 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
DRD2 P14416 3/20 0.41
UCHL1 P09936 1/20 0.41
PTPN1 P18031 1/20 0.41

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
SCHEMBL2081318 1.00 MEN1 (0.53) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL31359949 1.00 MEN1 (0.53) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL31158720 1.00 MEN1 (0.53) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL2082826 1.00 MEN1 (0.53) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL30299421 1.00 MEN1 (0.53) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL18914431 0.89 OPRD1 (0.48) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL27406117 0.89 OPRD1 (0.50) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL10207323 0.89 OPRD1 (0.50) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL5570014 0.88 OPRD1 (0.52) MEN1KMT2AOPRD1NAMPTNR1D1
SCHEMBL5064869 0.88 OPRD1 (0.49) MEN1KMT2AOPRD1NAMPTNR1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586170-B Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-04-09 CN claimed
CN-117586170-A Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-02-23 CN claimed
WO-2009130015-A1 IMPROVED RAF INHIBITORS GPC BIOTECH AG (DE) 2009-10-29 WO claimed
CN-117586170-B Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-04-09 CN disclosed
CN-117586170-A Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative 江苏集萃分子工程研究院有限公司 2024-02-23 CN disclosed
US-20230062119-A1 USE OF BIOMARKERS IN IDENTIFYING PATIENTS THAT WILL BE RESPONSIVE TO TREATMENT WITH A PRMT5 INHIBITOR MERCK SHARP & DOHME LLC (US) 2023-03-02 US disclosed
WO-2021126999-A1 USE OF BIOMARKERS IN IDENTIFYING PATIENTS THAT WILL BE RESPONSIVE TO TREATMENT WITH A PRMT5 INHIBITOR MERCK SHARP & DOHME CORP. (US) 2021-06-24 WO disclosed
US-11028101-B2 3-oxa-8-azabicyclo[3.2.1]octane derivatives and their use in the treatment of cancer and hemoglobinopathies CTXT PTY LTD (AU) 2021-06-08 US disclosed
US-10947234-B2 PRMT5 inhibitors MERCK SHARP & DOHME CORP. (US) 2021-03-16 US disclosed
EP-3426351-B1 BENZOPIPERIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER AND HEMOGLOBINOPATHIES CTXT PTY LTD (AU) 2020-12-09 EP disclosed
US-20200361931-A1 PRMT5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-11-19 US disclosed
US-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
US-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
WO-2007115058-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE NOVARTIS AG (CH) 2007-10-11 WO disclosed
WO-2005113510-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2005-12-01 WO disclosed
EP-1598341-A1 DPP-IV inhibitors Santhera Pharmaceuticals (Deutschland) Aktiengesellschaft (DE) 2005-11-23 EP disclosed
EP-1149079-B1 TETRAHYDRO ISOQUINO LINEALKANOL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SK CORP (KR) 2004-04-21 EP disclosed
EP-1149079-A1 TETRAHYDRO ISOQUINO LINEALKANOL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SK Corporation (KR) 2001-10-31 EP disclosed
WO-2000046204-A1 TETRAHYDRO ISOQUINO LINEALKANOL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SK CORPORATION (KR) 2000-08-10 WO disclosed
US-5955471-A USEFUL IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, INCLUDING DEPRESSION SK CORPORATION (US) 1999-09-21 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 (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-20200361931-A1 PRMT5 INHIBITORS PRMT5, PRMT1, PRMT6 MEN1 898/4885KMT2A 67/4885OPRD1 4383/4885
US-11028101-B2 3-oxa-8-azabicyclo[3.2.1]octane derivatives and their use in the treatment of cancer and hemoglobinopathies HBB, HBZ, HBG2 MEN1 362/4885KMT2A 110/4885OPRD1 127/4885
US-20070265301-A1 Dpp-IV Inhibitors DPP4, DPP8, DPP7 MEN1 1376/4885KMT2A 1722/4885OPRD1 1112/4885
US-10947234-B2 PRMT5 inhibitors PRMT5, PRMT1, PRMT6 MEN1 898/4885KMT2A 67/4885OPRD1 4383/4885

“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.