Niraparib

Niraparib

SCHEMBL3659848

NC(=O)c1cccc2cn(-c3ccc([C@@H]4CCCNC4)cc3)nc12.O=C(O)CCC(=O)O

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PARP1PARP2

The experimentally established mechanism targets of Niraparib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 known ✓ P09874 20/20 0.89
PARP2 known ✓ Q9UGN5 13/20 0.89
PARP3 Q9Y6F1 12/20 0.89
TNKS O95271 1/20 0.89
CHRM2 P08172 1/20 0.89
CHRM1 P11229 1/20 0.89
SLC6A2 P23975 1/20 0.89
SLC6A4 P31645 1/20 0.89
ADRA1A P35348 1/20 0.89
SLC6A3 Q01959 1/20 0.89
KCNH2 Q12809 1/20 0.89
DYRK1A Q13627 1/20 0.89
PARP15 Q460N3 1/20 0.89
PARP14 Q460N5 1/20 0.89
PARP10 Q53GL7 1/20 0.89
PARP12 Q9H0J9 1/20 0.89
TNKS2 Q9H2K2 1/20 0.89
PARP4 Q9UKK3 1/20 0.89
DYRK1B Q9Y463 1/20 0.89
HRH3 Q9Y5N1 1/20 0.89

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
Niraparib SCHEMBL3659845 1.00 PARP1 (0.89) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL1421875 0.94 PARP1 (1.00) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL1422151 0.94 PARP1 (1.00) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL1421952 0.94 PARP1 (1.00) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL567839 0.93 PARP1 (0.98) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL28370623 0.93 PARP1 (0.98) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL567840 0.93 PARP1 (0.98) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL1422061 0.93 PARP1 (0.98) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL28129248 0.92 PARP1 (0.77) PARP1PARP2PARP3TNKSCHRM2
Niraparib SCHEMBL3740349 0.92 PARP1 (0.91) 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
EP-2240466-B1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 2-{4-[(3S)-PIPERIDIN-3- YL]PHENYL} -2H-INDAZOLE-7-CARBOXAMIDE MERCK SHARP & DOHME (GB) 2015-07-29 EP claimed
US-20100286203-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 2--2H-INDAZOLE-7-CARBOXAMIDE MERCK SHARP & DOHME LLC 2010-11-11 US claimed
EP-2240466-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 2-{4-[(3S)-PIPERIDIN-3- YL]PHENYL} -2H-INDAZOLE-7-CARBOXAMIDE Merck Sharp & Dohme Limited (GB) 2010-10-20 EP claimed
WO-2009087381-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 2-{4-[(3S)-PIPERIDIN-3- YL]PHENYL} -2H-INDAZOLE-7-CARBOXAMIDE MERCK SHARP & DOHME LTD (GB) 2009-07-16 WO claimed
EP-2240466-B1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 2-{4-[(3S)-PIPERIDIN-3- YL]PHENYL} -2H-INDAZOLE-7-CARBOXAMIDE MERCK SHARP & DOHME (GB) 2015-07-29 EP disclosed
US-8436185-B2 Pharmaceutically acceptable salts of 2-{4-[(3S)-piperidin-3-yl]phenyl}-2H-indazole-7-carboxamide MERCK SHARP & DOHME CORP. (US) 2013-05-07 US disclosed
US-20100286203-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 2--2H-INDAZOLE-7-CARBOXAMIDE MERCK SHARP & DOHME LLC 2010-11-11 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 (1 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-20100286203-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 2--2H-INDAZOLE-7-CARBOXAMIDE PARP1, PARP12, PARP15 PARP1 1/4885PARP2 6/4885PARP3 7/4885

“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.