SCHEMBL24948585

SCHEMBL24948585

c1cc(-c2cc3ccccc3c3ccccc23)cc(N(c2ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)cc2)c2ccc(-c3cccc4ccccc34)cc2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
CYP11B1 P15538 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
MPI P34949 1/20 0.32
KMT2A Q03164 1/20 0.32
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31

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
SCHEMBL24948619 1.00 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL24948622 1.00 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL24949196 0.95 MCL1 (0.32) MCL1ACMSDCA12CA1CA2
SCHEMBL24948588 0.94 CYP11B1 (0.33) MCL1ACMSDCA12CA1CA2
SCHEMBL24946900 0.94 MCL1 (0.38) MCL1ACMSDCA12CA1CA2
SCHEMBL27012074 0.94 MCL1 (0.38) MCL1ACMSDCA12CA1CA2
SCHEMBL24946898 0.94 MCL1 (0.38) MCL1ACMSDCA12CA1CA2
SCHEMBL24949391 0.94 CYP11B1 (0.33) MCL1ACMSDCA12CA1CA2
SCHEMBL24902342 0.94 CA12 (0.39) MCL1ACMSDCA12CA1CA2
SCHEMBL24903092 0.93 CA12 (0.36) MCL1ACMSDCA12CA1CA2

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