SCHEMBL26423660

SCHEMBL26423660

c1cc2sc3cc4ncncc4cc3c2cn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.39
CYP2A6 P11509 4/20 0.36
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
CSNK1D P48730 1/20 0.33
CSNK1E P49674 1/20 0.33
CLK1 P49759 1/20 0.33
DYRK1A Q13627 1/20 0.33
TDO2 P48775 2/20 0.32
HASPIN Q8TF76 1/20 0.32
BAZ1A Q9NRL2 1/20 0.32

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
SCHEMBL26423675 0.94 EGFR (0.39) EGFRCYP2A6PIK3CDPIK3CAKDM4E
SCHEMBL26423661 0.88 EGFR (0.39) EGFRCYP2A6PIK3CDPIK3CAKDM4E
SCHEMBL19758397 0.83 EGFR (0.44) EGFRPIK3CDPIK3CAALDH1A1TDO2
SCHEMBL26423602 0.82 NPC1 (0.39) CYP2A6KDM4EALDH1A1HTT
SCHEMBL26423681 0.82 EGFR (0.39) EGFRCYP2A6PIK3CDPIK3CAKDM4E
SCHEMBL26423684 0.80 EGFR (0.39) EGFRPIK3CDPIK3CATDO2BAZ1A
SCHEMBL26423600 0.79 HASPIN (0.41) CYP2A6CSNK1DCSNK1ECLK1DYRK1A
SCHEMBL26423599 0.79 HASPIN (0.41) CYP2A6CSNK1DCSNK1ECLK1DYRK1A
SCHEMBL26423745 0.78 EGFR (0.33) EGFRCYP2A6
SCHEMBL19758396 0.77 EGFR (0.44) EGFRPIK3CDPIK3CAALDH1A1TDO2

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-20230127291-A1 HETEROCYCLIC ARYLAMINE COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY PANEL WUHAN TIANMA MICROELECTRONICS CO., LTD. (CN) 2023-04-27 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-20230127291-A1 HETEROCYCLIC ARYLAMINE COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY PANEL OCIAD2, OCIAD1, AZI2 EGFR 1270/4885CYP2A6 1228/4885PIK3CD 2623/4885

“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.