SCHEMBL20004793

SCHEMBL20004793

CC1CN(c2cc3c(cc2Br)C(=O)c2c([nH]c4cc(C#N)ccc24)C3(C)C)CC(C)N1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.77
EML4 Q9HC35 2/20 0.59
SRPK2 P78362 1/20 0.59
SRPK1 Q96SB4 1/20 0.59
KDR P35968 3/20 0.58
KIT P10721 1/20 0.57

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
SCHEMBL29962636 1.00 ALK (0.77) ALKEML4SRPK2SRPK1KDR
SCHEMBL898598 1.00 ALK (0.77) ALKEML4SRPK2SRPK1KDR
SCHEMBL21443264 0.91 ALK (0.64) ALKEML4SRPK2SRPK1KDR
SCHEMBL898529 0.89 ALK (0.77) ALKEML4SRPK2SRPK1KDR
SCHEMBL20004319 0.89 ALK (0.77) ALKEML4SRPK2SRPK1KDR
SCHEMBL898456 0.87 ALK (1.00) ALKKDRKIT
SCHEMBL29962368 0.87 ALK (1.00) ALKKDRKIT
SCHEMBL20366423 0.87 ALK (1.00) ALKKDRKIT
SCHEMBL20004401 0.87 ALK (1.00) ALKKDRKIT
SCHEMBL897298 0.86 ALK (0.81) ALKEML4SRPK2SRPK1KDR

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