SCHEMBL17527349

SCHEMBL17527349

CCN1CC[P](O)(c2ccc(Nc3cc(Nc4ccccc4S(=O)(=O)C(C)C)cnn3)c(OC)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 18/20 0.47
▸ ROS1 P08922 7/20 0.47
▸ INSR P06213 2/20 0.42
▸ GAK O14976 1/20 0.42
▸ IGF1R P08069 1/20 0.42
▸ INSRR P14616 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ LTK P29376 1/20 0.42
▸ TTK P33981 1/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ PTK2 Q05397 1/20 0.42
▸ TNK2 Q07912 1/20 0.42
▸ TNK1 Q13470 1/20 0.42
▸ PTK2B Q14289 1/20 0.42
▸ MET P08581 2/20 0.40
▸ EGFR P00533 1/20 0.39
▸ FES P07332 1/20 0.39
▸ FLT3 P36888 1/20 0.39
▸ ZAP70 P43403 1/20 0.39

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
SCHEMBL11916348 0.92 ALK (0.46) ALKROS1INSRGAKIGF1R
SCHEMBL17527401 0.81 ALK (0.54) ALKROS1INSRGAKIGF1R
SCHEMBL17527378 0.81 ALK (0.57) ALKROS1INSRIGF1RMET
SCHEMBL11916352 0.79 ALK (0.51) ALKROS1INSRGAKIGF1R
SCHEMBL11916349 0.79 ALK (0.54) ALKROS1INSRGAKIGF1R
SCHEMBL11916340 0.77 ALK (0.61) ALKROS1INSRGAKIGF1R
SCHEMBL17527459 0.77 ALK (0.58) ALKROS1INSRGAKIGF1R
SCHEMBL17527398 0.76 ALK (0.54) ALKROS1INSRGAKIGF1R
SCHEMBL18350609 0.76 ALK (0.53) ALKROS1INSRGAKIGF1R
SCHEMBL11916350 0.74 ALK (0.58) ALKROS1INSRGAKIGF1R

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
US-9273077-B2 Phosphorus derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2016-03-01 — — US claimed
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