SCHEMBL23966901

SCHEMBL23966901

OCCn1cc(I)c2c(Cl)ncnc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADK P55263 8/20 0.48
SLC29A1 Q99808 1/20 0.48
DYRK3 O43781 1/20 0.41
ROCK2 O75116 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
PHKG2 P15735 1/20 0.41
PRKACA P17612 1/20 0.41
RPS6KB1 P23443 1/20 0.41
MARK3 P27448 1/20 0.41
FLT3 P36888 1/20 0.41
CSNK1A1 P48729 1/20 0.41
CSNK1D P48730 1/20 0.41
CLK2 P49760 1/20 0.41
IRAK1 P51617 1/20 0.41
CSNK1G2 P78368 1/20 0.41
MAP4K2 Q12851 1/20 0.41
ROCK1 Q13464 1/20 0.41
CAMK2G Q13555 1/20 0.41
CAMK2D Q13557 1/20 0.41

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
SCHEMBL16236456 0.86 ADK (0.43) ADKSLC29A1DYRK3ROCK2PRKD3
SCHEMBL16236531 0.84 ADK (0.44) ADKSLC29A1DYRK3ROCK2PRKD3
SCHEMBL16236535 0.84 ADK (0.44) ADKSLC29A1DYRK3ROCK2PRKD3
SCHEMBL24072919 0.83 ADK (0.46) ADKSLC29A1SRCLCKTEK
SCHEMBL28589607 0.82 ADK (0.42) ADKSLC29A1DYRK3ROCK2PRKD3
SCHEMBL8445449 0.81 ADK (0.44) ADKSLC29A1DYRK3ROCK2PRKD3
SCHEMBL23966679 0.81 DYRK3 (0.60) ADKDYRK3ROCK2PRKD3MAP4K4
SCHEMBL29032350 0.81 DYRK3 (0.41) ADKSLC29A1DYRK3ROCK2PRKD3
SCHEMBL16236999 0.81 ADK (0.46) ADKSLC29A1DYRK3ROCK2PRKD3
SCHEMBL29503417 0.81 ADK (0.46) ADKSLC29A1DYRK3ROCK2PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-113683629-B Substituted heteroaryl compounds, compositions and uses thereof 北京范恩柯尔生物科技有限公司 2023-07-04 CN disclosed
US-20230129710-A1 Methods and Reagents for Synthesizing Nucleosides and Analogues Thereof SIMON FRASER UNIVERSITY (CA) 2023-04-27 US disclosed
US-20230129710-A1 Methods and Reagents for Synthesizing Nucleosides and Analogues Thereof SIMON FRASER UNIVERSITY (CA) 2023-04-27 US disclosed
CN-115843272-A Inhibitors of NEK7 kinase 哈利亚治疗公司 2023-03-24 CN disclosed
WO-2021242505-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-02 WO disclosed
CN-113683629-A Substituted heteroaryl compounds, compositions and uses thereof 北京范恩柯尔生物科技有限公司 2021-11-23 CN 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-20230129710-A1 Methods and Reagents for Synthesizing Nucleosides and Analogues Thereof NUDT1, ADAR, APRT ADK 149/4885SLC29A1 29/4885DYRK3 2851/4885
US-20210355130-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 ADK 72/4885SLC29A1 1626/4885DYRK3 580/4885
US-11713321-B2 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 ADK 72/4885SLC29A1 1626/4885DYRK3 580/4885
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 ADK 286/4885SLC29A1 2077/4885DYRK3 3229/4885
US-11161852-B1 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 ADK 72/4885SLC29A1 1626/4885DYRK3 580/4885

“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.