SCHEMBL467792

SCHEMBL467792

Nc1nc(N)n(-c2ccc(N3CCC(N4CCCC4)C3)c(F)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AXL P30530 3/20 0.44
L3MBTL3 Q96JM7 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
FGFR1 P11362 2/20 0.35
FLT1 P17948 2/20 0.35
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
KDR P35968 2/20 0.34
INSR P06213 1/20 0.34
MBTD1 Q05BQ5 1/20 0.34
HTR6 P50406 1/20 0.33
KHK P50053 2/20 0.33
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL467688 0.95 AXL (0.40) AXLADORA2AADORA1KDRINSR
SCHEMBL467659 0.93 AXL (0.49) AXLL3MBTL3L3MBTL1FGFR1FLT1
SCHEMBL467833 0.90 AXL (0.47) AXLL3MBTL3L3MBTL1FGFR1FLT1
SCHEMBL467696 0.84 AXL (0.43) AXLL3MBTL1FGFR1KDRINSR
SCHEMBL467478 0.84 AXL (0.42) AXLKDRINSR
SCHEMBL27769653 0.84 AXL (0.42) AXLL3MBTL3L3MBTL1KDRINSR
SCHEMBL27790975 0.83 AXL (0.47) AXLKDRINSRHRH3
SCHEMBL30090809 0.83 AXL (0.47) AXLKDRINSRHRH3
SCHEMBL28997487 0.82 AXL (0.35) AXLADORA2AADORA1
SCHEMBL28997485 0.82 AXL (0.35) AXLADORA2AADORA1

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
EP-2387395-A1 AXL INHIBITORS FOR USE IN COMBINATION THERAPY FOR PREVENTING, TREATING OR MANAGING METASTATIC CANCER Rigel Pharmaceuticals, Inc. (US) 2011-11-23 EP disclosed
US-8040491-B2 Exposure method, substrate stage, exposure apparatus, and device manufacturing method NIKON CORPORATION (JP) 2011-10-18 US disclosed