SCHEMBL3673375

SCHEMBL3673375

COc1ccc(Cl)c(Nc2ncnc3cc(OCC4CCNCC4C)c(OC)cc23)c1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.66
SRC P12931 5/20 0.66
EGFR P00533 3/20 0.55
FGFR1 P11362 3/20 0.55
FLT1 P17948 3/20 0.55
FLT4 P35916 3/20 0.55
EPHA2 P29317 11/20 0.54
EPHB4 P54760 5/20 0.54
ERBB2 P04626 1/20 0.53
RET P07949 1/20 0.52
KIF5B P33176 1/20 0.52

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
SCHEMBL3206677 0.87 KDR (0.79) KDRSRCEGFRFGFR1FLT1
Hydrochloric Acid SCHEMBL7591152 0.86 KDR (0.78) KDRSRCEGFRFGFR1FLT1
SCHEMBL7580342 0.81 SRC (0.76) KDRSRCEGFRFLT1EPHA2
SCHEMBL7580350 0.81 SRC (0.76) KDRSRCEGFRFLT1EPHA2
SCHEMBL7572205 0.81 SRC (0.76) KDRSRCEGFRFLT1EPHA2
SCHEMBL7167285 0.80 ENPP1 (0.55) KDREGFRFGFR1FLT1FLT4
Azm-475271 SCHEMBL29388701 0.80 KDR (1.00) KDRSRCEGFRFGFR1FLT1
Azm-475271 SCHEMBL3195079 0.80 KDR (1.00) KDRSRCEGFRFGFR1FLT1
SCHEMBL7573786 0.76 SRC (0.80) KDRSRCEGFRFLT1EPHA2
SCHEMBL3186078 0.76 KDR (0.71) KDRSRCEGFRFGFR1FLT1

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-1562612-B1 COMBINATION PRODUCT OF INHIBITOR OF THE SRC FAMILY OF NON-RECEPTOR TYROSINE KINASES AND GEMCITABINE FOR USE IN THE TREATMENT OR PROPHLAXIX OF PANCREATIC CANCER ASTRAZENECA AB (SE) 2010-01-27 EP disclosed