SCHEMBL217432

SCHEMBL217432

O=C1NCC2c3ccccc3Oc3cccc1c32

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 9/20 0.40
PARP3 Q9Y6F1 1/20 0.40
NISCH Q9Y2I1 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CDC7 O00311 1/20 0.36
ATM Q13315 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP19A1 P11511 1/20 0.35
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34

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
SCHEMBL30312068 1.00 PARP1 (0.40) PARP1PARP3NISCHMAOAMAOB
SCHEMBL29802419 1.00 PARP1 (0.40) PARP1PARP3NISCHMAOAMAOB
SCHEMBL14336651 0.84 GAA (0.39) PARP1KMT2ACYP19A1
SCHEMBL14336465 0.80 PARP1 (0.34) PARP1PARP3
SCHEMBL14336724 0.80 PARP1 (0.33) PARP1CDC7
SCHEMBL29960421 0.75 HTR2A (0.55) PARP1PARP3MAOACA12CA9
SCHEMBL7142349 0.75 LMNA (0.39) PARP1NISCHMAOAMAOBATM
SCHEMBL14336530 0.74 HTT (0.44) MEN1LMNAKMT2A
SCHEMBL14336466 0.72 PHGDH (0.40) PARP1LMNAMAPTKMT2A
SCHEMBL7144469 0.72 NISCH (0.40) PARP1NISCHMAOAMAOBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4282490-A2 FIBRONECTIN-BINDING PEPTIDES FOR USE IN TUMOR OR FIBROSIS DIAGNOSIS AND THERAPY ETH Zürich (CH) 2023-11-29 EP disclosed
US-11649268-B2 Fibronectin-binding peptides for use in tumor or fibrosis diagnosis and therapy ETH ZURICH (CH) 2023-05-16 US disclosed
EP-4028009-A1 TREATMENT OF HR DEFICIENT CANCER The Francis Crick Institute Limited (GB) 2022-07-20 EP disclosed
US-20210393791-A1 COMBINATION TREATMENT WITH ANTI-CD123 ANTIBODY DRUG CONJUGATE AND PARP INHIBITOR HEALTH RESEARCH, INC. (US) 2021-12-23 US disclosed
US-20210322475-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE UAB RESEARCH FOUNDATION 2021-10-21 US disclosed
US-20210244706-A1 DNA Damage Repair Inhibitors for Treatment of Cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-08-12 US disclosed
WO-2021048235-A1 TREATMENT OF HR DEFICIENT CANCER THE FRANCIS CRICK INSTITUTE LIMITED (GB) 2021-03-18 WO disclosed
US-20210046072-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L KING'S COLLEGE LONDON (GB) 2021-02-18 US disclosed
EP-3325623-B3 USE OF A COMBINATION OF DBAIT MOLECULE AND PARP INHIBITORS TO TREAT CANCER INST CURIE (FR) 2021-01-20 EP disclosed
US-10874641-B2 Methods of treating acute kidney injury MITOBRIDGE, INC. (US) 2020-12-29 US disclosed
US-20050172365-A1 Expression vector for improve exogenous gene transfer and transcription; transgenic organisms preferably plants which comprise these systems SUNGENE GMBH & CO. KGAA (DE) 2005-08-04 US disclosed
EP-1557414-A1 ISOQUINOLINE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2005-07-27 EP disclosed
EP-1531683-A2 USE OF ASTAXANTHIN-CONTAINING PLANTS OR PARTS OF PLANTS OF THE GENUS TAGETES AS ANIMAL FEED Sungene GmbH & Co. KGaA (DE) 2005-05-25 EP disclosed
US-20040248931-A1 Isoquinoline compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-12-09 US disclosed
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-09-09 US disclosed
EP-1407034-A2 RECOMBINATION SYSTEMS AND A METHOD FOR REMOVING NUCLEIC ACID SEQUENCES FROM THE GENOME OF EUKARYOTIC ORGANISMS Sungene GmbH & Co. KgAA (DE) 2004-04-14 EP disclosed
EP-1396488-A1 FUSED HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-03-10 EP disclosed
WO-2004017749-A2 USE OF ASTAXANTHIN-CONTAINING PLANTS OR PARTS OF PLANTS OF THE GENUS TAGETES AS ANIMAL FEED SUNGENE GMBH & CO. KGAA (DE) 2004-03-04 WO disclosed
US-6514983-B1 Inhibitors of the nucleic enzyme poly(adenosine 5'-diphospho-ribose)polymerase GUILFORD PHARMACEUTICALS INC. 2003-02-04 US disclosed
WO-2003004659-A2 RECOMBINATION SYSTEMS AND A METHOD FOR REMOVING NUCLEIC ACID SEQUENCES FROM THE GENOME OF EUKARYOTIC ORGANISMS SUNGENE GMBH & CO. KGAA (DE) 2003-01-16 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 (6 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-10874641-B2 Methods of treating acute kidney injury PARP1, PARP3, PARP11 PARP1 1/4885PARP3 2/4885NISCH 4616/4885
US-20040248931-A1 Isoquinoline compound and pharmaceutical use thereof NQO1, PARP1, PARP11 PARP1 2/4885PARP3 5/4885NISCH 1197/4885
US-20210046072-A1 COMBINATION OF AN INHIBITOR OF PARP WITH AN INHIBITOR OF GSK-3 OR DOT1L PARP3, PARP11, GSK3A PARP1 5/4885PARP3 1/4885NISCH 4878/4885
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof PARP11, PARP1, CD38 PARP1 2/4885PARP3 7/4885NISCH 2021/4885
US-20210244706-A1 DNA Damage Repair Inhibitors for Treatment of Cancer PARP2, MRE11, PARP1 PARP1 3/4885PARP3 15/4885NISCH 4609/4885
US-20210393791-A1 COMBINATION TREATMENT WITH ANTI-CD123 ANTIBODY DRUG CONJUGATE AND PARP INHIBITOR PARP3, PARP1, PARP11 PARP1 2/4885PARP3 1/4885NISCH 4871/4885

“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.