SCHEMBL26055009

SCHEMBL26055009

c1ccc(-c2ccc(N(c3cccc(-c4cccc5ccccc45)c3)c3ccc4c(ccc5c6ccccc6ccc45)c3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.44
ACMSD Q8TDX5 1/20 0.44
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
HPRT1 P00492 3/20 0.38
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 3/20 0.36
CYP1B1 Q16678 2/20 0.36
HIF1A Q16665 2/20 0.36
EDNRB P24530 1/20 0.36
EDNRA P25101 1/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
MPI P34949 1/20 0.36
KMT2A Q03164 1/20 0.36
TLR8 Q9NR97 1/20 0.35

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
SCHEMBL26063260 0.97 MCL1 (0.46) MCL1ACMSDCA12CA1CA2
SCHEMBL26062363 0.96 MCL1 (0.43) MCL1ACMSDCA12CA1CA2
SCHEMBL23239479 0.96 MCL1 (0.43) MCL1ACMSDCA12CA1CA2
SCHEMBL26054824 0.96 CA12 (0.45) MCL1ACMSDCA12CA1CA2
SCHEMBL23239393 0.96 MCL1 (0.43) MCL1ACMSDCA12CA1CA2
SCHEMBL23237576 0.96 MCL1 (0.43) MCL1ACMSDCA12CA1CA2
SCHEMBL25089232 0.96 CA12 (0.42) MCL1ACMSDCA12CA1CA2
SCHEMBL23238255 0.96 MCL1 (0.43) MCL1ACMSDCA12CA1CA2
SCHEMBL24816487 0.96 CA12 (0.44) MCL1ACMSDCA12CA1CA2
SCHEMBL26055595 0.96 MCL1 (0.45) 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
EP-4235829-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-08-30 EP disclosed