SCHEMBL26423698

SCHEMBL26423698

c1cnc2nc3sc4ncccc4c3nc2c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 3/20 0.44
CLK1 P49759 3/20 0.44
CDC7 O00311 1/20 0.44
DBF4 Q9UBU7 1/20 0.44
PDK1 Q15118 1/20 0.42
IKBKB O14920 1/20 0.37
CHUK O15111 1/20 0.37
POLB P06746 1/20 0.37
PRKCI P41743 2/20 0.37
LMNA P02545 3/20 0.37
KDM4E B2RXH2 2/20 0.36
MAPT P10636 1/20 0.36
PIK3CA P42336 2/20 0.36
MAPK14 Q16539 1/20 0.36
ALDH1A1 P00352 1/20 0.35
NPC1 O15118 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL26423662 0.86 LIMK1 (0.46) LIMK1CLK1CDC7DBF4PDK1
SCHEMBL26423703 0.78 LIMK1 (0.41) LIMK1CLK1PDK1POLBLMNA
SCHEMBL26423709 0.77 KDM4E (0.38) LIMK1CLK1CDC7DBF4PDK1
SCHEMBL26423694 0.76 MAPK14 (0.38) PDK1POLBLMNAKDM4EMAPK14
SCHEMBL26423696 0.76 LIMK1 (0.41) LIMK1CLK1CDC7DBF4PDK1
SCHEMBL13344056 0.75 ALDH1A1 (0.48) POLBLMNAKDM4EMAPTMAPK14
SCHEMBL4903332 0.74 LIMK1 (0.50) LIMK1CLK1CDC7DBF4PDK1
SCHEMBL26423708 0.74 LIMK1 (0.40) LIMK1CLK1CDC7DBF4PDK1
SCHEMBL19233003 0.74 DHFR (0.53) LMNAKDM4EMAPTMAPK14ALDH1A1
SCHEMBL24623623 0.74 LIMK1 (0.51) LIMK1CLK1CDC7DBF4PDK1

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 LIMK1 1525/4885CLK1 4489/4885CDC7 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.