SCHEMBL30180452

SCHEMBL30180452

N#Cc1ccc2nccc(Nc3ccc(C(=O)Nc4ccc(Nc5ccncc5)cc4)nc3)c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
USP2 O75604 2/20 0.54
KMT2A Q03164 2/20 0.54
DNMT1 P26358 4/20 0.53
DNMT3A Q9Y6K1 3/20 0.53
MAPKAPK2 P49137 3/20 0.51
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
THRB P10828 1/20 0.50
MAPK1 P28482 1/20 0.50
MCL1 Q07820 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
GAK O14976 1/20 0.48
RIPK2 O43353 1/20 0.48
COQ8A Q8NI60 1/20 0.48
NLK Q9UBE8 1/20 0.48
DNMT3L Q9UJW3 1/20 0.45
PPARG P37231 1/20 0.45
LRRK2 Q5S007 2/20 0.44

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
SCHEMBL19151512 1.00 MAPT (0.54) MAPTUSP2KMT2ADNMT1DNMT3A
Trifluoroacetic Acid SCHEMBL30180324 0.94 MAPT (0.49) MAPTUSP2KMT2ADNMT1DNMT3A
Trifluoroacetic Acid SCHEMBL28974304 0.94 MAPT (0.49) MAPTUSP2KMT2ADNMT1DNMT3A
SCHEMBL24003814 0.94 DNMT1 (0.49) MAPTUSP2KMT2ADNMT1DNMT3A
SCHEMBL25826586 0.92 DNMT1 (0.51) MAPTUSP2KMT2ADNMT1DNMT3A
SCHEMBL24006215 0.91 MAPT (0.55) MAPTUSP2KMT2ADNMT1DNMT3A
SCHEMBL25847943 0.90 MAPKAPK2 (0.48) MAPTUSP2KMT2ADNMT1DNMT3A
SCHEMBL30180283 0.89 DNMT1 (0.68) MAPTUSP2KMT2ADNMT1DNMT3A
SCHEMBL23999615 0.89 DNMT1 (0.68) MAPTUSP2KMT2ADNMT1DNMT3A
SCHEMBL30180638 0.89 DNMT1 (0.68) MAPTUSP2KMT2ADNMT1DNMT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4426279-A1 AKT3 MODULATORS Georgiamune Inc. (US) 2024-09-11 EP disclosed
CN-118524833-A AKT3 modulators 乔治穆内公司 2024-08-20 CN disclosed
WO-2023081854-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 WO disclosed
CN-115867562-A AKT3 modulators 乔治穆内有限责任公司 2023-03-28 CN disclosed
EP-4146667-A1 AKT3 MODULATORS Georgiamune LLC (US) 2023-03-15 EP disclosed