SCHEMBL17004667

SCHEMBL17004667

CS(=O)(=O)N1CCN(Cc2ccc3c(c2)Cc2c(-c4csc(C#CCOCC5CC5)c4)n[nH]c2-3)CC1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.84
FYN P06241 2/20 0.84
CSF1R P07333 2/20 0.84
KIT P10721 2/20 0.84
FLT1 P17948 2/20 0.84
FLT4 P35916 2/20 0.84
FLT3 P36888 2/20 0.84
PLK4 O00444 1/20 0.84
CHEK1 O14757 1/20 0.84
IKBKB O14920 1/20 0.84
RPS6KA5 O75582 1/20 0.84
PRKD3 O94806 1/20 0.84
MAP4K4 O95819 1/20 0.84
CHEK2 O96017 1/20 0.84
NTRK1 P04629 1/20 0.84
LCK P06239 1/20 0.84
LYN P07948 1/20 0.84
PIM1 P11309 1/20 0.84
FGFR1 P11362 1/20 0.84
PHKG2 P15735 1/20 0.84

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
SCHEMBL4815705 0.91 KDR (1.00) KDRFYNCSF1RKITFLT1
SCHEMBL4818952 0.89 KDR (0.85) KDRFYNCSF1RKITFLT1
SCHEMBL4814169 0.89 KDR (0.84) KDRFYNCSF1RKITFLT1
SCHEMBL4814636 0.89 KDR (0.86) KDRFYNCSF1RKITFLT1
SCHEMBL4818510 0.85 KDR (0.78) KDRFYNCSF1RKITFLT1
SCHEMBL4816652 0.84 KDR (0.60) KDRFYNCSF1RKITFLT1
SCHEMBL4812211 0.84 KDR (0.82) KDRFYNCSF1RKITFLT1
SCHEMBL4818515 0.84 KDR (0.77) KDRFYNCSF1RKITFLT1
SCHEMBL4814537 0.82 KDR (0.89) KDRFYNCSF1RKITFLT1
SCHEMBL4819380 0.81 KDR (0.76) KDRFYNCSF1RKITFLT1

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
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed