SCHEMBL24679546

SCHEMBL24679546

c1ccc(-n2c3ccccc3c3c(-c4cccc(-c5cccc(N(c6ccc(-c7cccc8ccccc78)cc6)c6cccc7ccccc67)c5)c4)cccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ALK Q9UM73 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NTSR1 P30989 2/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL24679924 0.99 CA12 (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL23659367 0.98 MCL1 (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL23659473 0.97 KDM4E (0.33) MCL1ACMSDALKKDM4EATM
SCHEMBL24679133 0.97 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL23660295 0.96 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL23659166 0.96 KDM4E (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL24680246 0.96 KDM4E (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL24678981 0.96 KDM4E (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL23659488 0.96 KDM4E (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL24678826 0.95 KDM4E (0.35) MCL1ACMSDKDM4EATML3MBTL1

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
EP-4092011-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd. (JP) 2022-11-23 EP disclosed