SCHEMBL24006175

SCHEMBL24006175

Cc1c(Nc2ccnc3ccc(C#N)cc23)cccc1C(=O)Nc1ccc(Nc2ccncc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 5/20 0.49
DNMT3A Q9Y6K1 3/20 0.49
USP2 O75604 2/20 0.49
MAPT P10636 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
THRB P10828 1/20 0.49
MAPK1 P28482 1/20 0.49
MCL1 Q07820 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPKAPK2 P49137 3/20 0.47
GAK O14976 1/20 0.44
RIPK2 O43353 1/20 0.44
COQ8A Q8NI60 1/20 0.44
NLK Q9UBE8 1/20 0.44
DNMT3L Q9UJW3 1/20 0.41
BRAF P15056 2/20 0.41
RAF1 P04049 1/20 0.41

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
SCHEMBL25487272 0.95 DNMT1 (0.48) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL24006018 0.89 DNMT1 (0.49) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL25820606 0.89 DNMT1 (0.51) DNMT1DNMT3AMAPKAPK2GAKRIPK2
SCHEMBL24006007 0.86 DNMT1 (0.52) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL30180518 0.85 USP2 (0.56) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL24006176 0.85 USP2 (0.54) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL23999430 0.85 USP2 (0.56) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL24003752 0.85 DNMT1 (0.55) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL24003754 0.84 USP2 (0.51) DNMT1DNMT3AUSP2MAPTKMT2A
SCHEMBL25487269 0.84 BRAF (0.51) DNMT1DNMT3AUSP2MAPTKMT2A

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