SCHEMBL26489166

SCHEMBL26489166

c1ccc(-c2cccc(N(c3ccc(-c4cccc(-n5c6ccccc6c6c7ccccc7ccc65)c4-c4ccccc4)cc3)c3cccc(-c4ccc5ccccc5c4)c3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL24949749 0.99 AKT1 (0.30) AKT1
SCHEMBL24949747 0.93 MCL1 (0.33) CA12CA1CA2CA9
SCHEMBL24949199 0.93 AKT1 (0.32) AKT1CA12CA1CA2CA9
SCHEMBL24949200 0.92 AKT1 (0.32) AKT1CA12CA1CA2CA9
SCHEMBL26487897 0.92 AKT1 (0.34) AKT1CA12CA1CA2CA9
SCHEMBL26488107 0.92 AKT1 (0.34) AKT1CA12CA1CA2CA9
SCHEMBL26488938 0.92 AKT1 (0.34) AKT1CA12CA1CA2CA9
SCHEMBL26488102 0.92 AKT1 (0.34) AKT1CA12CA1CA2CA9
SCHEMBL26488782 0.92 AKT1 (0.30) AKT1
SCHEMBL24948036 0.91 CA12 (0.32) AKT1CA12CA1CA2CA9

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-2023182836-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-09-28 WO disclosed