SCHEMBL26423734

SCHEMBL26423734

c1cnc2sc3cc4cncnc4nc3c2c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 6/20 0.40
LIMK1 P53667 3/20 0.40
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40
PIK3CA P42336 1/20 0.36
EGFR P00533 1/20 0.34
LMNA P02545 1/20 0.34
PRKCI P41743 5/20 0.33
TLR5 O60602 1/20 0.32
IKBKB O14920 1/20 0.32
CHUK O15111 1/20 0.32
CYP2A6 P11509 1/20 0.31
NPC1 O15118 1/20 0.31
HSP90AA1 P07900 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL26423737 0.81 CLK1 (0.40) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL26423739 0.80 LIMK1 (0.36) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL26423719 0.80 LIMK1 (0.40) CLK1LIMK1EGFRLMNANPC1
SCHEMBL26423744 0.78 LIMK1 (0.35) CLK1LIMK1EGFRLMNANPC1
SCHEMBL2855389 0.77 CLK1 (0.51) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL26423717 0.77 CYP2A6 (0.36) CLK1CYP2A6
SCHEMBL26423722 0.77 CDK5 (0.33) CLK1LIMK1CYP2A6
SCHEMBL26423677 0.76 EGFR (0.38) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL26423708 0.75 LIMK1 (0.40) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL26423577 0.74 LIMK1 (0.41) CLK1LIMK1CDC7DBF4PIK3CA

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 CLK1 4489/4885LIMK1 1525/4885CDC7 1258/4885

“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.