SCHEMBL30701905

SCHEMBL30701905

Clc1cccc(COc2cncc(-c3cnn(C4CCNCC4)c3)c2)c1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 2/20 0.75
MAP4K3 Q8IVH8 12/20 0.71
ALK Q9UM73 1/20 0.53
MET P08581 2/20 0.53
PAK1 Q13153 2/20 0.50
GRK5 P34947 1/20 0.49

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
SCHEMBL26151162 0.86 INPPL1 (0.74) INPPL1MAP4K3ALKMETPAK1
Hydrochloric Acid SCHEMBL30701910 0.85 INPPL1 (0.98) INPPL1MAP4K3ALKMETPAK1
SCHEMBL30701925 0.83 INPPL1 (0.82) INPPL1MAP4K3ALKMETPAK1
Hydrochloric Acid SCHEMBL30701912 0.83 INPPL1 (0.81) INPPL1MAP4K3ALKMETPAK1
SCHEMBL30701926 0.82 INPPL1 (0.52) INPPL1MAP4K3MET
SCHEMBL26151168 0.82 MAP4K3 (0.70) INPPL1MAP4K3ALKMETPAK1
SCHEMBL30701929 0.80 INPPL1 (0.70) INPPL1MAP4K3ALKMETPAK1
Trifluoroacetic Acid SCHEMBL30701928 0.79 INPPL1 (0.63) INPPL1MAP4K3ALKMETPAK1
SCHEMBL26151213 0.78 INPPL1 (0.62) INPPL1MAP4K3ALKPAK1
SCHEMBL16322009 0.75 INPPL1 (0.65) INPPL1MAP4K3ALKMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4554936-A1 CRIZOTINIB ANALOGUES AS SHIP1 INHIBITORS USEFUL TO TREAT ALZHEINER'S DISEASES The Trustees of Indiana University (US) 2025-05-21 EP disclosed
WO-2024015759-A1 CRIZOTINIB ANALOGUES AS SHIP1 INHIBITORS USEFUL TO TREAT ALZHEINER'S DISEASES THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-01-18 WO disclosed