SCHEMBL24949883

SCHEMBL24949883

c1ccc(-c2cc(-c3cccc4ccccc34)ccc2N(c2ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)cc2)c2cccc(-c3cccc4ccccc34)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.36
ACMSD Q8TDX5 1/20 0.36
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
PPARG P37231 3/20 0.31
PPARA Q07869 3/20 0.31
NTSR1 P30989 2/20 0.31
MAPK14 Q16539 1/20 0.31
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
FLT3 P36888 1/20 0.30
BMX P51813 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TNF P01375 1/20 0.30
TUBB4A P04350 1/20 0.30
TUBB P07437 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
SCHEMBL24948204 1.00 MCL1 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL24949290 0.99 MCL1 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL27352132 0.99 MCL1 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL24949280 0.99 MCL1 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL24949276 0.98 CA12 (0.37) MCL1ACMSDCA12CA1CA2
SCHEMBL27361358 0.98 CA12 (0.37) MCL1ACMSDCA12CA1CA2
SCHEMBL24949652 0.98 CA12 (0.37) MCL1ACMSDCA12CA1CA2
SCHEMBL24949653 0.98 CA12 (0.37) MCL1ACMSDCA12CA1CA2
SCHEMBL27352135 0.97 CA12 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL27361085 0.97 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 1 patent. claimed = in the patent's claims; disclosed = body only.

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