SCHEMBL21743067

SCHEMBL21743067

COC(=O)c1cccc2cn(-c3ccc([C@@H]4CCCN(C(=O)OC(C)(C)C)C4)cc3)nc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 16/20 0.50
PARP2 Q9UGN5 5/20 0.49
PARP3 Q9Y6F1 5/20 0.49
TNKS O95271 1/20 0.49
CHRM2 P08172 1/20 0.49
CHRM1 P11229 1/20 0.49
SLC6A2 P23975 1/20 0.49
SLC6A4 P31645 1/20 0.49
ADRA1A P35348 1/20 0.49
SLC6A3 Q01959 1/20 0.49
KCNH2 Q12809 1/20 0.49
DYRK1A Q13627 1/20 0.49
PARP15 Q460N3 1/20 0.49
PARP14 Q460N5 1/20 0.49
PARP10 Q53GL7 1/20 0.49
PARP12 Q9H0J9 1/20 0.49
TNKS2 Q9H2K2 1/20 0.49
PARP4 Q9UKK3 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49

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
SCHEMBL1422522 1.00 PARP1 (0.50) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL1421860 0.91 PARP1 (0.61) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL5016308 0.91 PARP1 (0.61) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL23854758 0.90 PARP1 (0.61) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL1421856 0.90 PARP1 (0.61) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL28614035 0.90 PARP1 (0.52) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL15777224 0.90 PARP1 (0.49) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL15777226 0.90 PARP1 (0.49) PARP1PARP2PARP3TNKSCHRM2
Lithium Ion SCHEMBL29393507 0.90 PARP1 (0.50) PARP1PARP2PARP3TNKSCHRM2
SCHEMBL28677563 0.87 PARP1 (0.44) PARP1PARP2PARP3TNKSCHRM2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025017711-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF NIRAPARIB TOSYLATE MONOHYDRATE NATCO PHARMA LIMITED (IN) 2025-01-23 WO disclosed
CN-118271233-A Nilaparil manufacturing method 特沙诺有限公司 2024-07-02 CN disclosed
US-11629137-B2 Methods of manufacturing of niraparib TESARO, INC. (US) 2023-04-18 US disclosed
EP-3615513-B1 METHODS OF MANUFACTURING OF NIRAPARIB TESARO INC (US) 2022-07-20 EP disclosed
US-20220041575-A1 METHODS OF MANUFACTURING OF NIRAPARIB TESARO, INC. 2022-02-10 US disclosed
US-11161834-B2 Methods of manufacturing of niraparib TESARO, INC. (US) 2021-11-02 US disclosed
US-20200055837-A1 METHODS OF MANUFACTURING OF NIRAPARIB TESARO, INC. 2020-02-20 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-20200055837-A1 METHODS OF MANUFACTURING OF NIRAPARIB PARP2, PARP1, PARP3 PARP1 2/4885PARP2 1/4885PARP3 3/4885
US-20220041575-A1 METHODS OF MANUFACTURING OF NIRAPARIB PARP2, PARP1, PARP3 PARP1 2/4885PARP2 1/4885PARP3 3/4885
US-11161834-B2 Methods of manufacturing of niraparib PARP2, PARP1, PARP3 PARP1 2/4885PARP2 1/4885PARP3 3/4885
US-11629137-B2 Methods of manufacturing of niraparib PARP2, PARP1, PARP3 PARP1 2/4885PARP2 1/4885PARP3 3/4885

“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.