SCHEMBL7812909

SCHEMBL7812909

C=S(=O)(c1cc2c(cc1N1CCN(C(C)C)CC1)C(C)(C)c1[nH]c3cc(N)ccc3c1C2=O)N(C)C

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.51
EML4 Q9HC35 2/20 0.44
SRPK2 P78362 1/20 0.44
SRPK1 Q96SB4 1/20 0.44
KDR P35968 2/20 0.42
KIT P10721 1/20 0.41

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
SCHEMBL7806976 0.89 ALK (0.54) ALKEML4SRPK2SRPK1KDR
SCHEMBL1755876 0.89 ALK (0.51) ALKEML4SRPK2SRPK1KDR
SCHEMBL1755863 0.87 ALK (0.68) ALKEML4SRPK2SRPK1KDR
SCHEMBL7812737 0.84 ALK (0.55) ALKEML4SRPK2SRPK1KDR
SCHEMBL1755874 0.84 ALK (0.59) ALKEML4SRPK2SRPK1KDR
SCHEMBL7809636 0.82 ALK (0.61) ALKEML4SRPK2SRPK1KDR
SCHEMBL1755802 0.82 ALK (0.58) ALKEML4SRPK2SRPK1KDR
SCHEMBL7805522 0.80 ALK (0.59) ALKEML4SRPK2SRPK1KDR
SCHEMBL7814687 0.80 ALK (0.46) ALKSRPK2SRPK1
SCHEMBL897025 0.80 ALK (0.77) 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
WO-2010143664-A1 TETRACYCLIC COMPOUND 中外製薬株式会社 (JP) 2010-12-16 WO disclosed