SCHEMBL22236229

SCHEMBL22236229

CC(C)Oc1cncc(C(=O)Nc2c[nH]nc2C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 16/20 0.76
CLK2 P49760 10/20 0.76
CLK3 P49761 9/20 0.76
GSK3B P49841 7/20 0.50
MAPK7 Q13164 1/20 0.48
NAMPT P43490 2/20 0.41
TDO2 P48775 1/20 0.40

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
SCHEMBL22236116 0.92 DYRK1A (0.64) DYRK1ACLK2CLK3GSK3BMAPK7
SCHEMBL22235838 0.89 DYRK1A (0.59) DYRK1ACLK2CLK3GSK3BMAPK7
SCHEMBL22236189 0.88 DYRK1A (0.59) DYRK1ACLK2CLK3GSK3BMAPK7
SCHEMBL22236259 0.86 DYRK1A (0.57) DYRK1ACLK2CLK3GSK3BMAPK7
SCHEMBL22258419 0.85 DYRK1A (0.60) DYRK1ACLK2CLK3GSK3BMAPK7
SCHEMBL22236190 0.83 DYRK1A (0.52) DYRK1ACLK2CLK3GSK3B
SCHEMBL22236034 0.79 DYRK1A (0.54) DYRK1ACLK2CLK3GSK3B
SCHEMBL22235785 0.78 DYRK1A (0.47) DYRK1ACLK2CLK3GSK3BMAPK7
SCHEMBL22236176 0.78 DYRK1A (0.47) DYRK1ACLK2CLK3GSK3BMAPK7
SCHEMBL22258432 0.77 DYRK1A (0.55) DYRK1ACLK2CLK3GSK3BMAPK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230000842-A1 METHODS OF TREATING CARTILAGE DISORDERS THROUGH INHIBITION OF CLK AND DYRK VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2023-01-05 US disclosed
WO-2020150545-A1 PYRAZOLE DERIVATIVES AS MODULATORS OF THE WNT/B-CATENIN SIGNALING PATHWAY SAMUMED, LLC (US) 2020-07-23 WO disclosed
WO-2020150545-A1 PYRAZOLE DERIVATIVES AS MODULATORS OF THE WNT/B-CATENIN SIGNALING PATHWAY SAMUMED, LLC (US) 2020-07-23 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 (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-20230000842-A1 METHODS OF TREATING CARTILAGE DISORDERS THROUGH INHIBITION OF CLK AND DYRK CLK2, CLK3, CLK1 DYRK1A 7/4885CLK2 1/4885CLK3 2/4885

“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.