SCHEMBL30802400

SCHEMBL30802400

Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)O)cc1

nearest known ligand 0.87

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 0.87
AKT2 P31751 14/20 0.87
AKT3 Q9Y243 13/20 0.87
CYP2C9 P11712 2/20 0.64

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
SCHEMBL2191503 0.93 AKT1 (1.00) AKT1AKT2AKT3CYP2C9
SCHEMBL25386420 0.93 AKT1 (0.78) AKT1AKT2AKT3CYP2C9
SCHEMBL31455728 0.92 AKT1 (0.92) AKT1AKT2AKT3CYP2C9
SCHEMBL27385313 0.91 AKT1 (0.79) AKT1AKT2AKT3CYP2C9
SCHEMBL31455748 0.91 AKT1 (0.92) AKT1AKT2AKT3CYP2C9
SCHEMBL31455625 0.90 AKT1 (0.91) AKT1AKT2AKT3CYP2C9
SCHEMBL31455814 0.90 AKT1 (0.82) AKT1AKT2AKT3CYP2C9
SCHEMBL31455754 0.89 AKT1 (0.79) AKT1AKT2AKT3CYP2C9
SCHEMBL25384109 0.89 AKT1 (0.70) AKT1AKT2AKT3CYP2C9
SCHEMBL2191882 0.89 AKT1 (0.75) AKT1AKT2AKT3CYP2C9

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-2024054512-A1 AKT1 MODULATORS ALTEROME THERAPEUTICS, INC. (US) 2024-03-14 WO disclosed