SCHEMBL16159296

SCHEMBL16159296

c1ccc(-c2ccc3c(-c4cc(-c5cncs5)ccn4)c4ccccc4c(-c4cc(-c5cncs5)ccn4)c3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.47
CD38 P28907 11/20 0.43
DYRK1A Q13627 2/20 0.43
KDR P35968 1/20 0.43
PIK3CA P42336 1/20 0.39
DYRK2 Q92630 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
IMPDH2 P12268 1/20 0.36

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
SCHEMBL16159862 1.00 PIM1 (0.47) PIM1CD38DYRK1AKDRPIK3CA
SCHEMBL16159861 0.98 PIM1 (0.46) PIM1CD38DYRK1AKDRPIK3CA
SCHEMBL16159860 0.98 PIM1 (0.46) PIM1CD38DYRK1AKDRPIK3CA
SCHEMBL17704426 0.92 PIM1 (0.45) PIM1CD38DYRK1AKDRPIK3CA
SCHEMBL17704441 0.91 PIM1 (0.51) PIM1CD38DYRK1AKDRPIK3CA
SCHEMBL16159923 0.91 PIM1 (0.51) PIM1CD38DYRK1AKDRPIK3CA
SCHEMBL16159308 0.91 DYRK1A (0.47) PIM1CD38DYRK1AKDRDYRK2
SCHEMBL17704423 0.89 PIM1 (0.40) PIM1CD38DYRK1ADYRK2DYRK1B
SCHEMBL16159564 0.89 PIM1 (0.49) PIM1CD38DYRK1AKDRPIK3CA
SCHEMBL16159859 0.88 PIM1 (0.37) PIM1CD38DYRK1APIK3CA

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-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 US disclosed
US-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 US disclosed
WO-2014163173-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC株式会社 (JP) 2014-10-09 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-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME HVCN1, VDAC1, SLC26A3 PIM1 2642/4885CD38 2387/4885DYRK1A 3602/4885

“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.