SCHEMBL14733543

SCHEMBL14733543

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

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 16/20 0.64
DYRK1B Q9Y463 12/20 0.64
EGFR P00533 2/20 0.48
FLT1 P17948 1/20 0.48
NPC1 O15118 1/20 0.48
NCOA1 Q15788 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL14733529 0.87 DYRK1A (0.62) DYRK1ADYRK1BGSK3AGSK3BMAPT
SCHEMBL14733542 0.86 DYRK1A (0.68) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733587 0.85 DYRK1A (0.62) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733490 0.85 DYRK1A (0.61) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733507 0.85 DYRK1A (0.61) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL16038266 0.84 DYRK1A (0.60) DYRK1ADYRK1BEGFRFLT1GSK3A
SCHEMBL14733591 0.84 DYRK1A (0.64) DYRK1ADYRK1BGSK3AGSK3B
SCHEMBL14733487 0.84 DYRK1A (0.67) DYRK1ADYRK1BGSK3AGSK3BMAPT
SCHEMBL14733499 0.82 DYRK1A (0.63) DYRK1ADYRK1BEGFRGSK3AGSK3B
SCHEMBL14733493 0.80 DYRK1A (0.63) DYRK1ADYRK1BGSK3AGSK3B

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 7 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
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
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
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 2/4885EGFR 1408/4885

“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.