SCHEMBL6410067

SCHEMBL6410067

CCCC[Sn](CCCC)(CCCC)c1nccs1.[Li]CCCC

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.35
PDK1 Q15118 1/20 0.33

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
SCHEMBL42407 0.92 FBP1 (0.43) FBP1L3MBTL1PDK1
SCHEMBL23782857 0.88 FBP1 (0.41) FBP1L3MBTL1PDK1
SCHEMBL30489039 0.88 FBP1 (0.41) FBP1L3MBTL1PDK1
SCHEMBL12468929 0.81 FBP1 (0.41) FBP1L3MBTL1PDK1
SCHEMBL8619562 0.73 FBP1 (0.39) FBP1L3MBTL1PDK1
SCHEMBL8751701 0.68 L3MBTL1 (0.35) FBP1L3MBTL1
SCHEMBL6411351 0.68 ALDH1A1 (0.34)
SCHEMBL6036190 0.66 ALDH1A1 (0.33) L3MBTL1
SCHEMBL6412386 0.66 NPC1 (0.43) FBP1L3MBTL1PDK1
SCHEMBL155319 0.66 NOS1 (0.36)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1499616-A1 HETEROCYCLIC COMPOUNDS AstraZeneca AB (SE) 2005-01-26 EP disclosed
WO-2003087104-A1 HETEROCYCLIC COMPOUNDS ASTRAZENECA AB (SE) 2003-10-23 WO disclosed