SCHEMBL26423719

SCHEMBL26423719

c1cnc2c(c1)sc1cc3cncnc3nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.40
CLK1 P49759 1/20 0.40
METAP2 P50579 1/20 0.32
METAP1 P53582 1/20 0.32
EGFR P00533 1/20 0.32
CCR1 P32246 2/20 0.32
CCR5 P51681 2/20 0.32
CCR8 P51685 2/20 0.32
KDM4E B2RXH2 2/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
HSP90AA1 P07900 1/20 0.32
MMP2 P08253 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 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
SCHEMBL26423734 0.80 CLK1 (0.40) LIMK1CLK1EGFRLMNAHSP90AA1
SCHEMBL26423744 0.80 LIMK1 (0.35) LIMK1CLK1METAP2METAP1EGFR
SCHEMBL26423746 0.79 LIMK1 (0.40) LIMK1CLK1EGFRCCR1CCR5
SCHEMBL22483140 0.77 LIMK1 (0.53) LIMK1CLK1EGFRCCR1CCR5
SCHEMBL26423722 0.77 CDK5 (0.33) LIMK1CLK1KDM4EHTT
SCHEMBL26423717 0.77 CYP2A6 (0.36) CLK1
SCHEMBL26423674 0.75 EGFR (0.38) LIMK1CLK1EGFRKDM4ELMNA
SCHEMBL26423721 0.74 LIMK1 (0.40) LIMK1CLK1CCR1CCR5CCR8
SCHEMBL10054253 0.73 LIMK1 (0.57) LIMK1CLK1METAP2METAP1CCR1
SCHEMBL26423682 0.72 EGFR (0.38) LIMK1CLK1EGFRKDM4ELMNA

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 4489/4885METAP2 2396/4885

“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.