SCHEMBL21713233

SCHEMBL21713233

O=C(Nc1ccc(C2=CN(C(=O)O)CCC2)cc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.56
RAB9A P51151 7/20 0.52
NPC1 O15118 6/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
TP53 P04637 2/20 0.52
NFKB1 P19838 2/20 0.52
NFKB2 Q00653 2/20 0.52
RELA Q04206 2/20 0.52
MAPT P10636 2/20 0.52
PKM P14618 1/20 0.52
FFAR1 O14842 1/20 0.48
SIRT1 Q96EB6 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.47
HTT P42858 1/20 0.47
DEGS1 O15121 1/20 0.47
PTPN2 P17706 1/20 0.46

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
SCHEMBL21743090 0.85 PTPN1 (0.48) PTPN1RAB9ANPC1SMN1; SMN2TP53
SCHEMBL18085798 0.74 PTPN1 (1.00) PTPN1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL10136221 0.73 PTPN1 (0.96) PTPN1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL14160276 0.73 PTPN1 (0.96) PTPN1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL21713264 0.73 PTPN1 (0.55) PTPN1RAB9ANPC1SMN1; SMN2TP53
SCHEMBL126415 0.72 PTPN1 (0.87) PTPN1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL18103163 0.71 NPC1 (0.88) PTPN1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL14715824 0.71 NPC1 (0.88) PTPN1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL3659600 0.69 FFAR1 (0.89) PTPN1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL26953087 0.69 PTPN1 (0.88) PTPN1RAB9ANPC1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
CN-110753684-A Method for producing nilapali 特沙诺有限公司 2020-02-04 CN 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 (3 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 PTPN1 3196/4885RAB9A 3047/4885NPC1 4281/4885
US-11161834-B2 Methods of manufacturing of niraparib PARP2, PARP1, PARP3 PTPN1 3196/4885RAB9A 3047/4885NPC1 4281/4885
US-11629137-B2 Methods of manufacturing of niraparib PARP2, PARP1, PARP3 PTPN1 3196/4885RAB9A 3047/4885NPC1 4281/4885

“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.