SCHEMBL21032565

SCHEMBL21032565

Nc1ccc(C2=CCOCC2)c(F)c1[N+](=O)[O-]

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ KEAP1 Q14145 1/20 0.34
▸ NFE2L2 Q16236 1/20 0.34
▸ MAPK14 Q16539 2/20 0.34
▸ PDE3B Q13370 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ IDH2 P48735 1/20 0.32
▸ CDC7 O00311 1/20 0.30
▸ CDK2 P24941 1/20 0.30

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
SCHEMBL30168855 1.00 MEN1 (0.34) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL31570546 0.86 MEN1 (0.35) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL30056973 0.78 MAPK14 (0.32) MAPK14PDE3BPDE3A
SCHEMBL29516860 0.76 S100A4 (0.37) KMT2AMAPK14
SCHEMBL25529496 0.76 S100A4 (0.37) KMT2AMAPK14
SCHEMBL20764947 0.72 TDP1 (0.38) MEN1KMT2AMAPK14PDE3BPDE3A
SCHEMBL30439702 0.72 TDP1 (0.38) MEN1KMT2AMAPK14PDE3BPDE3A
SCHEMBL26162649 0.71 GRIN2D (0.37) MAPK14PDE3BPDE3AIDH2
SCHEMBL31094848 0.70 MAPT (0.57) MEN1KMT2AMAPK14
SCHEMBL19175120 0.70 AR (0.46) MAPK14PDE3BPDE3AIDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691970-B2 Pyrazolopyridinone compounds JANSSEN PHARMACEUTICA NV (BE) 2023-07-04 — — US disclosed
US-11691970-B2 Pyrazolopyridinone compounds JANSSEN PHARMACEUTICA NV (BE) 2023-07-04 — — US disclosed
US-11691970-B2 Pyrazolopyridinone compounds JANSSEN PHARMACEUTICA NV (BE) 2023-07-04 — — US disclosed
CN-111655690-B Pyrazolopyridinone compounds 詹森药业有限公司 2023-01-10 — — CN disclosed
EP-3713941-B1 PYRAZOLOPYRIDINONE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2022-06-22 — — EP disclosed
EP-3713941-B1 PYRAZOLOPYRIDINONE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2022-06-22 — — EP disclosed
US-20210147411-A1 PYRAZOLOPYRIDINONE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-05-20 — — US disclosed
US-20210147411-A1 PYRAZOLOPYRIDINONE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-05-20 — — US disclosed
CN-111655690-A Pyrazolopyridinone compounds 詹森药业有限公司 2020-09-11 — — CN disclosed
WO-2019101182-A1 PYRAZOLOPYRIDINONE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-05-31 — — 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 (2 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-20210147411-A1 PYRAZOLOPYRIDINONE COMPOUNDS FGFR1, FGFR3, FGFR2 MEN1 1975/4885USP2 4871/4885KMT2A 1583/4885
US-11691970-B2 Pyrazolopyridinone compounds FGFR1, FGFR3, FGFR2 MEN1 1975/4885USP2 4871/4885KMT2A 1583/4885

“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.

Send feedback