SCHEMBL7819947

SCHEMBL7819947

CC(C)c1cc2c(cc1N1CCN(C3CCC3)CC1)C(C)(C)c1[nH]c3cc(C=N)ccc3c1C2=O

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.63
KDR P35968 4/20 0.58
KIT P10721 2/20 0.49

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
SCHEMBL7805824 0.91 ALK (0.75) ALKKDRKIT
SCHEMBL7805890 0.90 ALK (0.61) ALKKDRKIT
SCHEMBL10272278 0.88 ALK (0.65) ALKKDRKIT
SCHEMBL7806236 0.86 ALK (0.63) ALKKDRKIT
SCHEMBL897186 0.86 ALK (0.84) ALKKDRKIT
SCHEMBL7801277 0.84 ALK (0.74) ALKKDRKIT
SCHEMBL1755866 0.83 ALK (0.65) ALKKDRKIT
SCHEMBL7806740 0.83 ALK (0.76) ALKKDRKIT
SCHEMBL7810830 0.82 ALK (0.71) ALKKDR
SCHEMBL21443259 0.82 ALK (0.72) ALKKDR

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
WO-2010143664-A1 TETRACYCLIC COMPOUND 中外製薬株式会社 (JP) 2010-12-16 WO disclosed