SCHEMBL5316737

SCHEMBL5316737

COc1ccc(-c2cnc(Nc3ccc4cn[nH]c4c3)o2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 6/20 0.55
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 1/20 0.54
F2 P00734 1/20 0.54
MAPT P10636 1/20 0.54
KDR P35968 7/20 0.53
FLT1 P17948 4/20 0.53
FLT4 P35916 4/20 0.53
TNIK Q9UKE5 1/20 0.49
SYK P43405 1/20 0.48
VCP P55072 1/20 0.48
RET P07949 1/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
RAF1 P04049 1/20 0.44
BRAF P15056 1/20 0.44
IGF1R P08069 1/20 0.44

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
SCHEMBL5318416 0.91 TNIK (0.60) IMPDH2KDRFLT1FLT4TNIK
SCHEMBL5333251 0.87 IMPDH2 (0.55) IMPDH2KDM4EALDH1A1MAPTKDR
SCHEMBL5334372 0.87 KDR (0.59) IMPDH2KDM4EALDH1A1MAPTKDR
SCHEMBL5339016 0.85 VCP (0.58) IMPDH2KDM4EALDH1A1MAPTKDR
SCHEMBL14465936 0.85 IMPDH2 (0.61) IMPDH2KDM4EMAPTKDRFLT1
SCHEMBL5342641 0.82 TRPV1 (0.61) IMPDH2KDRFLT1FLT4
SCHEMBL5339083 0.82 VCP (0.63) IMPDH2ALDH1A1MAPTKDRFLT1
SCHEMBL5338142 0.80 VCP (0.65) IMPDH2KDRFLT1FLT4TNIK
SCHEMBL5338255 0.79 IMPDH2 (0.57) IMPDH2KDRFLT1FLT4VCP
SCHEMBL5344443 0.78 KDR (0.59) IMPDH2KDRFLT1FLT4TNIK

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