SCHEMBL31455592

SCHEMBL31455592

Cc1cc(C(=O)O)ccc1C(=O)NCc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 0.79
AKT2 P31751 17/20 0.79
AKT3 Q9Y243 15/20 0.79
CYP2C9 P11712 3/20 0.62
CYP2C8 P10632 1/20 0.62
CYP2C19 P33261 1/20 0.62

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
SCHEMBL31455756 0.94 AKT1 (0.75) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455880 0.93 AKT1 (0.76) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455724 0.91 AKT1 (0.76) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455748 0.91 AKT1 (0.92) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455865 0.90 AKT1 (0.88) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455641 0.89 AKT1 (0.79) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455803 0.88 AKT1 (0.77) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL2191503 0.88 AKT1 (1.00) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455900 0.88 AKT1 (0.81) AKT1AKT2AKT3CYP2C9CYP2C8
SCHEMBL31455728 0.88 AKT1 (0.92) AKT1AKT2AKT3CYP2C9CYP2C8

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-2025059562-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS AND METHODS OF TREATING DISEASE USING SAME ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed