SCHEMBL30180392

SCHEMBL30180392

Cc1cc(Nc2ccc(NC(=O)c3ccc(Nc4ccnc5ccc(N6CCOCC6)cc45)cn3)cc2)ccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.54
RAB9A P51151 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPKAPK2 P49137 5/20 0.53
SLC2A1 P11166 1/20 0.49
MAPK10 P53779 3/20 0.49
NPC1 O15118 3/20 0.47
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CDK2 P24941 1/20 0.44
FLT3 P36888 1/20 0.44
CCNA1 P78396 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
MAPK9 P45984 1/20 0.43
MITF O75030 1/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL23999785 1.00 MAPT (0.54) MAPTRAB9ASMN1; SMN2ALDH1A1MAPKAPK2
SCHEMBL23999596 0.93 MAPT (0.48) MAPTRAB9ASMN1; SMN2ALDH1A1MAPKAPK2
SCHEMBL30180296 0.93 MAPT (0.48) MAPTRAB9ASMN1; SMN2ALDH1A1MAPKAPK2
SCHEMBL25826013 0.90 MAPKAPK2 (0.51) MAPTRAB9ASMN1; SMN2ALDH1A1MAPKAPK2
SCHEMBL24006299 0.88 DNMT1 (0.56) MAPTRAB9ASMN1; SMN2MAPKAPK2SLC2A1
SCHEMBL23999438 0.86 MAPT (0.49) MAPTRAB9ASMN1; SMN2ALDH1A1MAPKAPK2
SCHEMBL30180401 0.86 MAPT (0.49) MAPTRAB9ASMN1; SMN2ALDH1A1MAPKAPK2
SCHEMBL24006300 0.86 MAPK10 (0.52) MAPTRAB9ASMN1; SMN2ALDH1A1MAPKAPK2
SCHEMBL24005997 0.84 MAPKAPK2 (0.47) MAPTRAB9ASMN1; SMN2MAPKAPK2SLC2A1
SCHEMBL24006302 0.83 MAPKAPK2 (0.46) MAPTSMN1; SMN2MAPKAPK2SLC2A1MAPK10

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