SCHEMBL16255659

SCHEMBL16255659

CC1(C)C(=O)Nc2cccc(CNc3nc(Nc4ccc(C5CCNCC5)cc4O)ncc3Cl)c21

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.48
▸ MET P08581 1/20 0.47
▸ ALK Q9UM73 4/20 0.45
▸ KCNH2 Q12809 2/20 0.44
▸ INSR P06213 1/20 0.44
▸ STK17A Q9UEE5 1/20 0.44
▸ TNK2 Q07912 1/20 0.42
▸ NTRK1 P04629 3/20 0.41
▸ FLT4 P35916 3/20 0.40
▸ PTK2 Q05397 2/20 0.40
▸ KDR P35968 1/20 0.40
▸ IGF1R P08069 1/20 0.40

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
SCHEMBL10206156 0.92 ALK (0.48) EGFRMETALKKCNH2INSR
SCHEMBL10205156 0.92 EGFR (0.47) EGFRMETALKKCNH2INSR
SCHEMBL16255608 0.91 EGFR (0.47) EGFRALKINSRTNK2NTRK1
SCHEMBL10206144 0.90 EGFR (0.59) EGFRMETALKKCNH2INSR
SCHEMBL14331595 0.87 STK17A (0.58) EGFRMETSTK17ATNK2NTRK1
SCHEMBL10205066 0.87 PTK2 (0.51) EGFRMETALKKCNH2INSR
SCHEMBL10205832 0.87 ALK (0.53) EGFRMETALKKCNH2INSR
SCHEMBL10205064 0.86 ALK (0.42) EGFRMETALKKCNH2INSR
SCHEMBL10205062 0.85 ALK (0.49) EGFRMETALKKCNH2INSR
SCHEMBL10205075 0.84 STK17A (0.40) EGFRMETALKKCNH2INSR

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-2655358-B1 OXINDOLOPYRIMIDINE AS IGF1R RECEPTOR INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2014-11-19 — — EP disclosed
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