SCHEMBL20004118

SCHEMBL20004118

C#Cc1ccc2c3c([nH]c2c1)C(C)(C)c1cc(N2CCN(C4CCC4)CC2)c(C#C)cc1C3=O

nearest known ligand 0.89

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.89
KDR P35968 4/20 0.75
KIT P10721 2/20 0.75

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
SCHEMBL896881 0.94 ALK (1.00) ALKKDRKIT
SCHEMBL27087630 0.91 ALK (0.82) ALKKDRKIT
SCHEMBL21613411 0.91 ALK (0.85) ALKKDRKIT
SCHEMBL7809513 0.91 ALK (0.80) ALKKDRKIT
SCHEMBL897457 0.91 ALK (0.94) ALKKDRKIT
SCHEMBL29940561 0.91 ALK (0.82) ALKKDRKIT
SCHEMBL29940377 0.89 ALK (0.79) ALKKDRKIT
SCHEMBL27087534 0.89 ALK (0.79) ALKKDRKIT
SCHEMBL897292 0.88 ALK (0.88) ALKKDRKIT
SCHEMBL27087564 0.88 ALK (0.78) 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-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed