SCHEMBL5336415

SCHEMBL5336415

O=c1[nH]c2ccc(Nc3ncc(C4=COC=C(C5=CC=CCC5)O4)o3)cc2o1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.35
P2RX3 P56373 1/20 0.34
JAK3 P52333 2/20 0.33
JAK1 P23458 1/20 0.33
MAPKAPK2 P49137 4/20 0.33
VCP P55072 1/20 0.30
SMYD3 Q9H7B4 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL5339251 0.82 MKNK1 (0.38) SYKMAPKAPK2
SCHEMBL5337749 0.71 MKNK1 (0.37) SYKMAPKAPK2
SCHEMBL5316815 0.71 KDR (0.57) SYKVCP
SCHEMBL14465953 0.70 FLT1 (0.58) SYKJAK3JAK1MAPKAPK2VCP
SCHEMBL5336408 0.69 TUBB4A (0.42) SYKP2RX3JAK3JAK1MAPKAPK2
SCHEMBL5321701 0.69 ALOX5 (0.52) SYKVCP
SCHEMBL14466043 0.69 IMPDH2 (0.53) SYKJAK3JAK1VCP
SCHEMBL5318423 0.69 VCP (0.56) SYKP2RX3MAPKAPK2VCP
SCHEMBL6315791 0.68
SCHEMBL5339156 0.68 TUBB4A (0.39) SYKP2RX3JAK3JAK1MAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO claimed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed