SCHEMBL31471889

SCHEMBL31471889

OCCN1CCN(c2nc(Nc3cc(C4CC4)[nH]n3)c3ccccc3n2)CC1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PAK4 O96013 2/20 0.74
PAK1 Q13153 2/20 0.74
HTR2A P28223 12/20 0.61
DRD3 P35462 3/20 0.60

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
SCHEMBL31471972 0.88 PAK4 (0.83) PAK4PAK1
SCHEMBL22072524 0.88 PAK4 (0.83) PAK4PAK1
SCHEMBL31471765 0.85 PAK4 (0.81) PAK4PAK1
SCHEMBL22072090 0.85 PAK4 (0.77) PAK4PAK1
SCHEMBL22072089 0.84 PAK4 (0.79) PAK4PAK1
SCHEMBL31471941 0.83 PAK4 (0.71) PAK4PAK1
SCHEMBL22072085 0.81 PAK4 (0.66) PAK4PAK1
SCHEMBL31471728 0.81 PAK4 (0.73) PAK4PAK1
SCHEMBL31471860 0.80 PAK4 (0.73) PAK4PAK1
SCHEMBL31471928 0.79 PAK4 (0.66) PAK4PAK1

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
WO-2025100889-A1 QUINAZOLINE DERIVATIVE, SALT THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT 한국화학연구원 2025-05-15 WO disclosed