SCHEMBL20004252

SCHEMBL20004252

C#Cc1cc2c(cc1N1CCC(NSC)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.73
KDR P35968 3/20 0.70
KIT P10721 2/20 0.70
EML4 Q9HC35 1/20 0.59

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
SCHEMBL897406 0.89 ALK (0.80) ALKKDRKITEML4
SCHEMBL20004741 0.89 ALK (0.80) ALKKDRKITEML4
SCHEMBL20004251 0.89 ALK (0.78) ALKKDRKITEML4
SCHEMBL20004706 0.86 ALK (0.79) ALKKDRKITEML4
SCHEMBL897292 0.86 ALK (0.88) ALKKDRKITEML4
SCHEMBL897457 0.86 ALK (0.94) ALKKDRKIT
SCHEMBL27087577 0.85 ALK (0.67) ALKKDRKITEML4
SCHEMBL897286 0.85 ALK (1.00) ALKKDRKITEML4
SCHEMBL896881 0.84 ALK (1.00) ALKKDRKIT
SCHEMBL29895702 0.84 ALK (0.85) ALKKDRKITEML4

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-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed