SCHEMBL1755835

SCHEMBL1755835

CC1(C)c2cc(N3CCN(C4CC4)CC3)c(-c3cccs3)cc2C(=O)c2c1[nH]c1cc(N)ccc21

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.60
KDR P35968 4/20 0.56
KIT P10721 2/20 0.50
INSR P06213 1/20 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
SCHEMBL7815537 0.88 ALK (0.57) ALKKDRKITINSR
SCHEMBL896960 0.88 ALK (0.78) ALKKDRKITINSR
SCHEMBL10272642 0.87 ALK (0.78) ALKKDRKITINSR
SCHEMBL7806292 0.85 ALK (0.72) ALKKDRKITINSR
SCHEMBL7819599 0.85 ALK (0.64) ALKKDRKITINSR
SCHEMBL1755985 0.84 ALK (0.77) ALKKDRINSR
SCHEMBL1755834 0.83 ALK (0.65) ALKKDRKIT
SCHEMBL7806738 0.83 ALK (0.74) ALKKDRKITINSR
SCHEMBL1755898 0.82 ALK (0.74) ALKKDRINSR
SCHEMBL7817121 0.82 ALK (0.63) ALKKDRKIT

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-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed