SCHEMBL903267

SCHEMBL903267

COc1cc2c(Cc3ccc(N)cc3F)ccnc2cc1OCCCN1CCOCC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 4/20 0.74
EHMT2 Q96KQ7 4/20 0.55
EHMT1 Q9H9B1 4/20 0.55
SRC P12931 7/20 0.53
KDR P35968 6/20 0.53
EGFR P00533 6/20 0.53
FLT4 P35916 3/20 0.53
MET P08581 3/20 0.53
RET P07949 3/20 0.53
FLT3 P36888 3/20 0.53
CIT O14578 2/20 0.53
EPHB6 O15197 2/20 0.53
DAPK3 O43293 2/20 0.53
RIPK2 O43353 2/20 0.53
STK10 O94804 2/20 0.53
PRKD3 O94806 2/20 0.53
MAP4K4 O95819 2/20 0.53
CHEK2 O96017 2/20 0.53
ABL1 P00519 2/20 0.53
ERBB2 P04626 2/20 0.53

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
SCHEMBL14289180 0.85 AXL (1.00) AXLSRCKDREGFRFLT4
SCHEMBL30000966 0.85 AXL (1.00) AXLSRCKDREGFRFLT4
SCHEMBL166239 0.85 AXL (1.00) AXLSRCKDREGFRFLT4
SCHEMBL12469296 0.84 AXL (0.73) AXLEHMT2EHMT1SRCKDR
SCHEMBL10046591 0.83 AXL (0.72) AXLEHMT2EHMT1SRCKDR
SCHEMBL13679438 0.83 KIT (0.53) AXLEHMT2EHMT1SRCMET
SCHEMBL900298 0.81 AXL (0.69) AXLEHMT2EHMT1SRCKDR
SCHEMBL13667704 0.81 AXL (0.68) AXLSRCEGFRMETRIPK2
SCHEMBL14289192 0.81 AXL (0.92) AXLSRCKDREGFRFLT4
SCHEMBL1591152 0.81 AXL (0.92) AXLSRCKDREGFRFLT4

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-2012044577-A1 DUAL INHIBITORS OF MET AND VEGF FOR THE TREATMENT OF CASTRATION RESISTANT PROSTATE CANCER AND OSTEOBLASTIC BONE METASTASES EXELIXIS, INC. (US) 2012-04-05 WO disclosed
WO-2010065838-A1 METHODS OF PREPARING QUINOLINE DERIVATIVES EXELIXIS, INC. (US) 2010-06-10 WO disclosed
WO-2008035209-A2 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2008-03-27 WO disclosed