SCHEMBL5340970

SCHEMBL5340970

N#Cc1cccc(-c2cnc(Nc3ccc4[nH]ncc4c3)o2)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 4/20 0.61
KDR P35968 4/20 0.61
FLT4 P35916 3/20 0.61
PIK3CA P42336 1/20 0.56
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
IMPDH2 P12268 6/20 0.46
ROCK2 O75116 4/20 0.44
ADORA2A P29274 1/20 0.44
VCP P55072 1/20 0.43
EGFR P00533 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42

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
SCHEMBL5339170 0.88 FLT1 (0.53) FLT1KDRFLT4PIK3CAMAOA
SCHEMBL14465941 0.84 IMPDH2 (0.61) FLT1KDRFLT4PIK3CAIMPDH2
SCHEMBL5337614 0.84 PIK3CA (0.54) FLT1KDRFLT4PIK3CAIMPDH2
SCHEMBL5317045 0.84 VCP (0.63) FLT1KDRFLT4PIK3CAIMPDH2
SCHEMBL5336680 0.82 IMPDH2 (0.59) FLT1KDRFLT4PIK3CAIMPDH2
SCHEMBL5338142 0.81 VCP (0.65) FLT1KDRFLT4PIK3CAIMPDH2
SCHEMBL5343138 0.81 TRPV1 (0.53) FLT1KDRFLT4IMPDH2ROCK2
SCHEMBL5318247 0.81 IMPDH2 (0.57) FLT1KDRFLT4PIK3CAIMPDH2
SCHEMBL5319685 0.81 IMPDH2 (0.54) FLT1KDRFLT4PIK3CAIMPDH2
SCHEMBL5350220 0.80 VCP (0.67) PIK3CAMAOAMAOBIMPDH2ROCK2

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 3 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
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed