SCHEMBL5024064

SCHEMBL5024064

COc1cc(-c2csc3c(C=CC(=O)NCCCO)cnc(N)c23)ccc1NC(=O)c1cc2ccccc2n1C

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.85
FYN P06241 5/20 0.85
KDR P35968 2/20 0.85
CHEK1 O14757 1/20 0.85
AURKA O14965 1/20 0.85
JAK2 O60674 1/20 0.85
PRKD3 O94806 1/20 0.85
MAP4K4 O95819 1/20 0.85
PAK4 O96013 1/20 0.85
ABL1 P00519 1/20 0.85
NTRK1 P04629 1/20 0.85
CSF1R P07333 1/20 0.85
RET P07949 1/20 0.85
MET P08581 1/20 0.85
PDGFRB P09619 1/20 0.85
PIM1 P11309 1/20 0.85
FGFR1 P11362 1/20 0.85
PDGFRA P16234 1/20 0.85
PRKACA P17612 1/20 0.85
FLT1 P17948 1/20 0.85

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
SCHEMBL5024062 1.00 LCK (0.85) LCKFYNKDRCHEK1AURKA
SCHEMBL5025732 0.96 LCK (0.87) LCKFYNKDRCHEK1AURKA
SCHEMBL5025737 0.96 LCK (0.87) LCKFYNKDRCHEK1AURKA
SCHEMBL5025636 0.94 LCK (0.84) LCKFYNKDRCHEK1AURKA
SCHEMBL5025628 0.94 LCK (0.84) LCKFYNKDRCHEK1AURKA
SCHEMBL5015599 0.94 LCK (0.83) LCKFYNKDRCHEK1AURKA
SCHEMBL5015607 0.94 LCK (0.83) LCKFYNKDRCHEK1AURKA
SCHEMBL5024046 0.93 LCK (0.84) LCKFYNKDRCHEK1AURKA
SCHEMBL5024035 0.93 LCK (0.84) LCKFYNKDRCHEK1AURKA
SCHEMBL5015562 0.93 LCK (0.87) LCKFYNKDRCHEK1AURKA

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-1648905-B1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABBOTT LAB (US) 2008-12-31 EP disclosed