SCHEMBL24006178

SCHEMBL24006178

N#Cc1ccc2nccc(Nc3cccc(C(=O)Nc4ccc(Nc5ccncc5)nc4)c3)c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 7/20 0.56
DNMT3A Q9Y6K1 6/20 0.56
DNMT3L Q9UJW3 4/20 0.49
EHMT1 Q9H9B1 2/20 0.49
KMT2A Q03164 3/20 0.48
USP2 O75604 2/20 0.48
MAPT P10636 2/20 0.48
BRAF P15056 2/20 0.46
KDM4E B2RXH2 2/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
THRB P10828 1/20 0.43
MAPK1 P28482 1/20 0.43
MCL1 Q07820 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPKAPK2 P49137 2/20 0.43
GAK O14976 1/20 0.42
RIPK2 O43353 1/20 0.42
COQ8A Q8NI60 1/20 0.42

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
SCHEMBL24006217 0.93 DNMT1 (0.54) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL23999648 0.92 KMT2A (0.56) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL30180263 0.92 KMT2A (0.56) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL30287672 0.91 DNMT1 (0.65) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL31395379 0.91 DNMT1 (0.65) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL23244629 0.91 DNMT1 (0.65) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL24003769 0.91 DNMT1 (0.65) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL30290830 0.91 DNMT1 (0.56) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL24010542 0.91 DNMT1 (0.56) DNMT1DNMT3ADNMT3LEHMT1KMT2A
SCHEMBL25487871 0.89 DNMT1 (0.59) DNMT1DNMT3ADNMT3LEHMT1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023081845-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 WO disclosed
WO-2023081854-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 WO disclosed
WO-2021226477-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2021-11-11 WO disclosed