SCHEMBL25495474

SCHEMBL25495474

Cc1cc(N(C)c2cnc3[nH]c(-c4ccc(Nc5ccnc6ccc(N7CCOCC7)cc56)cc4)nc3c2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 15/20 0.50
▸ SLC2A1 P11166 1/20 0.47
▸ MAPT P10636 2/20 0.41
▸ MAPK10 P53779 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ PARP1 P09874 1/20 0.40

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
SCHEMBL26321380 0.91 MAPKAPK2 (0.48) MAPKAPK2SLC2A1MAPTPARP1
SCHEMBL23999518 0.89 MAPKAPK2 (0.47) MAPKAPK2SLC2A1PARP1
SCHEMBL30180429 0.86 MAPKAPK2 (0.53) MAPKAPK2SLC2A1MAPTMAPK10POLB
SCHEMBL23999521 0.86 MAPKAPK2 (0.53) MAPKAPK2SLC2A1MAPTMAPK10POLB
SCHEMBL26323527 0.86 MAPT (0.49) MAPKAPK2SLC2A1MAPTPOLBTSHR
SCHEMBL25495751 0.84 MAPKAPK2 (0.38) MAPKAPK2SLC2A1
SCHEMBL23999907 0.83 MAPKAPK2 (0.42) MAPKAPK2
SCHEMBL26321385 0.82 SLC2A1 (0.42) MAPKAPK2SLC2A1MAPT
SCHEMBL26321428 0.82 MAPKAPK2 (0.40) MAPKAPK2SLC2A1MAPK10
SCHEMBL23999835 0.81 SLC2A1 (0.41) MAPKAPK2SLC2A1MAPTMAPK10POLB

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
WO-2023081854-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 — — WO disclosed
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