SCHEMBL7812059

SCHEMBL7812059

CC1(C)c2cc(N3CCN(C4CC4)CC3)c(-c3cccnc3)cc2C(=O)c2c1[nH]c1cc(C=N)ccc21

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.62
KDR P35968 4/20 0.53
KIT P10721 2/20 0.47
INSR P06213 1/20 0.46

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
SCHEMBL7801277 0.91 ALK (0.74) ALKKDRKITINSR
SCHEMBL896488 0.87 ALK (0.83) ALKKDRKITINSR
SCHEMBL7806236 0.85 ALK (0.63) ALKKDRKITINSR
SCHEMBL7810830 0.82 ALK (0.71) ALKKDRINSR
SCHEMBL7819947 0.80 ALK (0.63) ALKKDRKIT
SCHEMBL21443259 0.79 ALK (0.72) ALKKDRINSR
SCHEMBL7806740 0.79 ALK (0.76) ALKKDRKITINSR
SCHEMBL10272642 0.79 ALK (0.78) ALKKDRKITINSR
SCHEMBL7807812 0.78 ALK (0.64) ALKKDRKITINSR
SCHEMBL7800511 0.78 ALK (0.62) ALKKDRKITINSR

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