SCHEMBL24948685

SCHEMBL24948685

c1ccc(-c2ccc(N(c3ccc(-c4c(-c5ccccc5)cccc4-n4c5ccccc5c5c6ccccc6ccc54)cc3)c3ccc(-c4cccc5ccccc45)cc3)c(-c3ccccc3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL24949906 0.93 CA12 (0.35) CA12CA1CA2CA9
SCHEMBL24947379 0.92 CA12 (0.37) CA12CA1CA2CA9
SCHEMBL26488788 0.92
SCHEMBL24949895 0.92 CA12 (0.33) CA12CA1CA2CA9
SCHEMBL26488460 0.91 PDE6D (0.31)
SCHEMBL26488774 0.91 CA12 (0.33) CA12CA1CA2CA9
SCHEMBL26488782 0.91 AKT1 (0.30)
SCHEMBL24947001 0.90 CA12 (0.30) CA12CA1CA2CA9
SCHEMBL26488464 0.89 PDE6D (0.31)
SCHEMBL24948675 0.89 MCL1 (0.32) CA12CA1CA2CA9

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
WO-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed