SCHEMBL17701232

SCHEMBL17701232

[c]1nccc(-c2cncs2)n1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.36
PIM1 P11309 3/20 0.35
DYRK2 Q92630 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
IMPDH2 P12268 1/20 0.33
MAPT P10636 1/20 0.31
HDAC8 Q9BY41 1/20 0.30

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
SCHEMBL17701224 0.70 PIM1 (0.37) DYRK1APIM1DYRK2DYRK1BIMPDH2
SCHEMBL8052675 0.68 MAPT (0.39) MAPT
SCHEMBL571374 0.67 HDAC8 (0.50) DYRK1APIM1DYRK2DYRK1BIMPDH2
SCHEMBL990825 0.67 CYP2A6 (0.39) PIM1
SCHEMBL17701217 0.67 DYRK1A (0.46) DYRK1APIM1DYRK2DYRK1BMAPT
SCHEMBL17701239 0.67 CD38 (0.32) HDAC8
SCHEMBL17701204 0.66 DYRK1A (0.41) DYRK1ADYRK2DYRK1BMAPTHDAC8
SCHEMBL29796804 0.66 MAPT (0.40) DYRK1APIM1DYRK2DYRK1BIMPDH2
SCHEMBL22895342 0.66 PIM1 (0.38) DYRK1APIM1DYRK2DYRK1BIMPDH2
SCHEMBL943994 0.65 NISCH (0.39) PIM1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 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 (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-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME HVCN1, VDAC1, SLC26A3 DYRK1A 3602/4885PIM1 2642/4885DYRK2 3520/4885

“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.