SCHEMBL5319664

SCHEMBL5319664

COc1ccc(-c2cnc(Nc3ccc4[nH]c(=O)oc4c3)o2)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 3/20 0.57
FLT4 P35916 3/20 0.57
KDR P35968 3/20 0.57
IMPDH2 P12268 9/20 0.47
ALPL P05186 1/20 0.43
VCP P55072 1/20 0.43
JAK2 O60674 3/20 0.42
CYP3A4 P08684 3/20 0.42
JAK1 P23458 3/20 0.42
JAK3 P52333 3/20 0.42
PDE10A Q9Y233 1/20 0.41
QPCT Q16769 1/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL5316768 0.85 FLT1 (0.54) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5319120 0.85 VCP (0.62) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5318330 0.84 IMPDH2 (0.48) FLT1FLT4KDRIMPDH2VCP
SCHEMBL14466043 0.84 IMPDH2 (0.53) FLT1FLT4KDRIMPDH2VCP
SCHEMBL14465953 0.82 FLT1 (0.58) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5318423 0.82 VCP (0.56) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5321701 0.82 ALOX5 (0.52) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5316815 0.82 KDR (0.57) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5336408 0.80 TUBB4A (0.42) FLT1KDRIMPDH2VCPJAK1
SCHEMBL5338884 0.79 FLT1 (0.59) FLT1FLT4KDRIMPDH2VCP

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