SCHEMBL27031807

SCHEMBL27031807

O=C1COc2cncc(c2)-c2n[nH]c3ccc(cc23)OCC(F)(F)CN1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 10/20 0.45
GSK3B P49841 9/20 0.45
CLK2 P49760 3/20 0.45
CLK3 P49761 3/20 0.45
LRRK2 Q5S007 5/20 0.32
MAP2K4 P45985 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
PIM1 P11309 1/20 0.31
WNT1 P04628 1/20 0.31
NTRK1 P04629 1/20 0.30

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
SCHEMBL29925262 1.00 DYRK1A (0.45) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL29925784 0.82 DYRK1A (0.44) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL29925212 0.81 DYRK1A (0.43) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL27031760 0.81 DYRK1A (0.43) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL24012781 0.76 GSK3B (0.35) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL30242435 0.76 GSK3B (0.35) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL29925496 0.75 GSK3B (0.39) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL29925849 0.75 GSK3B (0.39) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL27031843 0.75 GSK3B (0.39) DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL27031742 0.75 GSK3B (0.39) DYRK1AGSK3BCLK2CLK3LRRK2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240246992-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS SERVIER LAB (FR) 2024-07-25 US claimed
EP-4308570-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS Les Laboratoires Servier (FR) 2024-01-24 EP claimed
US-20240246992-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS SERVIER LAB (FR) 2024-07-25 US disclosed
EP-4308570-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS Les Laboratoires Servier (FR) 2024-01-24 EP 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-20240246992-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS LRRK2, PARK7, PINK1 DYRK1A 993/4885GSK3B 120/4885CLK2 16/4885

“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.