Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30701928

Clc1cccc(Cl)c1COc1cncc(-c2cnn(C3CCNCC3)c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 2/20 0.63
MAP4K3 Q8IVH8 5/20 0.50
JAK2 O60674 1/20 0.50
MET P08581 8/20 0.49
ALK Q9UM73 1/20 0.49
PAK1 Q13153 3/20 0.49
AURKA O14965 1/20 0.47
FLT3 P36888 1/20 0.47
MST1R Q04912 1/20 0.47
PAK4 O96013 2/20 0.47
PKN1 Q16512 1/20 0.47

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 0.91 INPPL1 (0.74) INPPL1MAP4K3JAK2METALK
SCHEMBL26151213 0.84 INPPL1 (0.62) INPPL1MAP4K3JAK2ALKPAK1
SCHEMBL30701925 0.81 INPPL1 (0.82) INPPL1MAP4K3JAK2METALK
Hydrochloric Acid SCHEMBL30701912 0.81 INPPL1 (0.81) INPPL1MAP4K3JAK2METALK
SCHEMBL30701905 0.79 INPPL1 (0.75) INPPL1MAP4K3METALKPAK1
Hydrochloric Acid SCHEMBL30701910 0.77 INPPL1 (0.98) INPPL1MAP4K3JAK2METALK
SCHEMBL16322009 0.75 INPPL1 (0.65) INPPL1MAP4K3JAK2METALK
SCHEMBL26151214 0.75 MAP4K3 (0.81) MAP4K3JAK2
SCHEMBL26151175 0.75 INPPL1 (0.55) INPPL1MAP4K3JAK2ALKPAK1
SCHEMBL26151375 0.74 ALK (0.64) INPPL1MAP4K3JAK2METALK

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