SCHEMBL24905798

SCHEMBL24905798

c1ccc(-c2nc(-c3ccc(-c4cccc5c4Sc4ccccc4C54c5ccccc5-c5ccccc54)cc3)cc(-c3cccc4ccccc34)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.36
MAPT P10636 8/20 0.36
MEN1 O00255 7/20 0.36
ALDH1A1 P00352 7/20 0.36
HPGD P15428 7/20 0.36
NTSR1 P30989 1/20 0.36
KDM4E B2RXH2 5/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
ATM Q13315 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GLA P06280 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
SCHEMBL24905557 1.00 KMT2A (0.36) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24905634 0.95 MEN1 (0.36) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24905786 0.95 MEN1 (0.36) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24648384 0.94 ALDH1A1 (0.35) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL21477937 0.94 MEN1 (0.36) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24648244 0.94 KMT2A (0.34) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24905431 0.94 ALDH1A1 (0.38) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24647814 0.93 KMT2A (0.35) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24647901 0.92 MEN1 (0.41) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24905616 0.92 MEN1 (0.41) KMT2AMAPTMEN1ALDH1A1HPGD

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
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed