SCHEMBL23917432

SCHEMBL23917432

Nc1ncnc2[nH]cc(-c3ccc(O)cc3)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.50
DYRK1A Q13627 5/20 0.49
DYRK1B Q9Y463 3/20 0.49
CLK1 P49759 2/20 0.49
DYRK2 Q92630 2/20 0.49
FLT3 P36888 3/20 0.48
SRC P12931 4/20 0.45
ABL1 P00519 3/20 0.45
EGFR P00533 3/20 0.45
ABL2 P42684 3/20 0.45
PRKD3 O94806 3/20 0.45
MAP4K4 O95819 3/20 0.45
PRKACA P17612 3/20 0.45
CLK2 P49760 3/20 0.45
GSK3A P49840 3/20 0.45
GSK3B P49841 3/20 0.45
CDK5 Q00535 3/20 0.45
MAP4K2 Q12851 3/20 0.45
ROCK1 Q13464 3/20 0.45
CLK4 Q9HAZ1 3/20 0.45

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
SCHEMBL2073031 0.92 LCK (0.54) LRRK2DYRK1ADYRK1BCLK1DYRK2
SCHEMBL24710755 0.87 LRRK2 (0.51) LRRK2DYRK1ADYRK1BCLK1DYRK2
SCHEMBL8107167 0.84 FLT3 (0.46) LRRK2DYRK1ADYRK1BFLT3SRC
SCHEMBL4352960 0.84 LRRK2 (0.58) LRRK2DYRK1ADYRK1BFLT3PRKD3
SCHEMBL3787081 0.84 SRC (0.50) LRRK2DYRK1ADYRK1BFLT3SRC
SCHEMBL1896766 0.84 STK3 (0.58) LRRK2DYRK1ADYRK1BFLT3SRC
SCHEMBL7021288 0.83 LRRK2 (0.63) LRRK2DYRK1ADYRK1BFLT3SRC
SCHEMBL28057752 0.82 RET (0.48) LRRK2DYRK1ADYRK1BFLT3PRKD3
SCHEMBL12438584 0.82 LRRK2 (0.55) LRRK2FLT3SRCABL1EGFR
SCHEMBL4350812 0.80 KDR (0.57) LRRK2DYRK1AFLT3SRCABL1

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-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 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-20210317140-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB LRRK2 684/4885DYRK1A 449/4885DYRK1B 387/4885

“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.