SCHEMBL14733591

SCHEMBL14733591

CC(C)(C)c1ccc(Nc2ncnc3ccc4nc(C#N)sc4c23)cc1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 18/20 0.64
DYRK1B Q9Y463 14/20 0.64
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
CSNK1D P48730 2/20 0.45
CSNK1G2 P78368 2/20 0.45

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
SCHEMBL14733499 0.89 DYRK1A (0.63) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733529 0.87 DYRK1A (0.62) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733542 0.86 DYRK1A (0.68) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733587 0.85 DYRK1A (0.62) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733507 0.85 DYRK1A (0.61) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733490 0.85 DYRK1A (0.61) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL16038266 0.84 DYRK1A (0.60) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733543 0.84 DYRK1A (0.64) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733487 0.84 DYRK1A (0.67) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL16038908 0.84 DYRK1A (0.46) DYRK1ADYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9446044-B2 DYRK1 inhibitors and uses thereof DIAXONHIT (FR) 2016-09-20 US disclosed
EP-2744797-B1 DYRK1 INHIBITORS AND USES THEREOF DIAXONHIT (FR) 2015-09-09 EP disclosed
US-20140275064-A1 DYRK1 INHIBITORS AND USES THEREOF DIAXONHIT (FR) 2014-09-18 US disclosed
WO-2013026806-A1 DYRK1 INHIBITORS AND USES THEREOF EXONHIT SA (FR) 2013-02-28 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-20140275064-A1 DYRK1 INHIBITORS AND USES THEREOF DYRK1A, DYRK1B, DYRK2 DYRK1A 1/4885DYRK1B 2/4885GSK3A 204/4885

“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.