SCHEMBL23999592

SCHEMBL23999592

CCNc1ccc2nccc(Nc3ccc(-c4nc5nc(Nc6ccnc(C)c6)ccc5[nH]4)nc3)c2c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 14/20 0.39
▸ EGFR P00533 1/20 0.33
▸ BCL6 P41182 1/20 0.33
▸ MAPKAPK2 P49137 1/20 0.33
▸ PRMT5 O14744 1/20 0.32
▸ RIPK2 O43353 1/20 0.32

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
SCHEMBL23999444 0.87 KDR (0.39) KDRMAPKAPK2RIPK2
SCHEMBL30180298 0.87 KDR (0.39) KDRMAPKAPK2RIPK2
SCHEMBL23999399 0.86 MAPKAPK2 (0.42) KDRMAPKAPK2RIPK2
SCHEMBL23999766 0.84 MAPKAPK2 (0.38) KDRMAPKAPK2
SCHEMBL23999591 0.83 KDR (0.39) KDREGFRMAPKAPK2RIPK2
SCHEMBL25484070 0.80 SLC2A1 (0.33) KDR
SCHEMBL23999588 0.80 PRMT5 (0.36) KDRPRMT5
SCHEMBL23999409 0.79 LRRK2 (0.40) MAPKAPK2RIPK2
SCHEMBL23999480 0.78 DNMT1 (0.38) —
SCHEMBL23999593 0.76 SLC2A1 (0.37) —

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-2021226519-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2021-11-11 — — WO disclosed
Send feedback