SCHEMBL15436262

SCHEMBL15436262

Nc1nc(N)n(-c2ccc(C3CCN(C4CC5CCC4C5)CC3)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AXL P30530 15/20 0.42
KDR P35968 10/20 0.41
SLC18A3 Q16572 2/20 0.37
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL10316679 0.86 AXL (0.55) AXLKDRKDM4E
SCHEMBL1640465 0.86 AXL (0.55) AXLKDRKDM4E
SCHEMBL10317023 0.78 AXL (0.52) AXLKDRKDM4E
SCHEMBL15754378 0.77 AXL (0.53) AXLKDR
SCHEMBL18009411 0.77 AXL (0.40) AXLKDRKDM4E
SCHEMBL28861630 0.76 KIT (0.48) AXLKDR
SCHEMBL15759220 0.73 SLC18A3 (0.56) SLC18A3KDM4E
SCHEMBL13468233 0.73 SLC18A3 (0.58) SLC18A3KDM4E
SCHEMBL30276317 0.72 TLR9 (0.38) SLC18A3
SCHEMBL10264029 0.70 SLC18A3 (0.40) SLC18A3KDM4E

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-2078010-B1 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2014-01-29 EP disclosed