SCHEMBL5637074

SCHEMBL5637074

CSc1ccc(-c2ccon2)c(C)c1Br

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
KDM4E B2RXH2 1/20 0.31
MDM2 Q00987 1/20 0.30

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
SCHEMBL5640472 0.75 GAA (0.41) GAAKDM4EMDM2
SCHEMBL5639859 0.69 GAA (0.39) GAAMDM2
SCHEMBL29483274 0.66 CNR2 (0.41) KDM4EMDM2
SCHEMBL5638801 0.66 GAA (0.34) GAAKDM4EMDM2
SCHEMBL8391170 0.63 NPC1 (0.38)
SCHEMBL28329033 0.62 NPC1 (0.44) GAAKDM4EMDM2
SCHEMBL3082762 0.61 NPC1 (0.42) GAAKDM4EMDM2
SCHEMBL29947384 0.61 IDO1 (0.44) GAAKDM4EMDM2
SCHEMBL2122583 0.61 NPC1 (0.45) GAAKDM4EMDM2
SCHEMBL29840757 0.61 NPC1 (0.45) GAAKDM4EMDM2

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
US-7301034-B2 Preparation of -4-thioalkybrobenzene derivatives BASF AKTIENGESELLSCHAFT (DE) 2007-11-27 US claimed