SCHEMBL23966679

SCHEMBL23966679

Nc1ncnc2c1c(I)cn2CCO

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK3 O43781 1/20 0.60
ROCK2 O75116 1/20 0.60
PRKD3 O94806 1/20 0.60
MAP4K4 O95819 1/20 0.60
PHKG2 P15735 1/20 0.60
PRKACA P17612 1/20 0.60
RPS6KB1 P23443 1/20 0.60
MARK3 P27448 1/20 0.60
FLT3 P36888 1/20 0.60
CSNK1A1 P48729 1/20 0.60
CSNK1D P48730 1/20 0.60
CLK2 P49760 1/20 0.60
IRAK1 P51617 1/20 0.60
CSNK1G2 P78368 1/20 0.60
MAP4K2 Q12851 1/20 0.60
ROCK1 Q13464 1/20 0.60
CAMK2G Q13555 1/20 0.60
CAMK2D Q13557 1/20 0.60
DYRK1A Q13627 1/20 0.60
MELK Q14680 1/20 0.60

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
SCHEMBL16236958 0.84 DYRK3 (0.60) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL16236518 0.84 DYRK3 (0.57) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL24072614 0.83 SRC (0.54) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL27217950 0.82 DYRK3 (0.55) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL8441851 0.81 DYRK3 (0.54) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL23966901 0.81 ADK (0.48) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL29032350 0.81 DYRK3 (0.41) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL3782622 0.81 DYRK3 (0.59) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL29503447 0.81 DYRK3 (0.59) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL15983880 0.81 ADORA2A (0.56) DYRK3ROCK2PRKD3MAP4K4PHKG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158394-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-05-16 US disclosed
CN-117597346-A NEK7 inhibitors 哈利亚治疗公司 2024-02-23 CN disclosed
EP-4320127-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2024-02-14 EP disclosed
US-11713321-B2 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2023-08-01 US disclosed
US-11713321-B2 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2023-08-01 US disclosed
US-11713321-B2 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2023-08-01 US disclosed
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 US disclosed
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 US disclosed
CN-115843272-A Inhibitors of NEK7 kinase 哈利亚治疗公司 2023-03-24 CN disclosed
WO-2022216680-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2022-10-13 WO disclosed
WO-2022212326-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2022-10-06 WO disclosed
WO-2022212326-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2022-10-06 WO disclosed
WO-2021242505-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-02 WO disclosed
US-20210355130-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. 2021-11-18 US disclosed
US-11161852-B1 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2021-11-02 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 (5 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-20210355130-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 DYRK3 580/4885ROCK2 1133/4885PRKD3 224/4885
US-11713321-B2 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 DYRK3 580/4885ROCK2 1133/4885PRKD3 224/4885
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 DYRK3 3229/4885ROCK2 2826/4885PRKD3 774/4885
US-11161852-B1 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 DYRK3 580/4885ROCK2 1133/4885PRKD3 224/4885
US-20240158394-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 DYRK3 1271/4885ROCK2 1375/4885PRKD3 792/4885

“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.