SCHEMBL5317362

SCHEMBL5317362

Brc1ccc2sccc2c1Br

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.34
HTT P42858 2/20 0.34
GAA P10253 1/20 0.34
HTR2C P28335 1/20 0.33
CYP2A6 P11509 1/20 0.32
HPGD P15428 1/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
ADRA2A P08913 1/20 0.30
ADRA2B P18089 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
SCHEMBL16047347 0.77 MAPT (0.34) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL31057213 0.77 MAPT (0.34) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL30714365 0.77 MAPT (0.34) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL10857949 0.77 MAPT (0.34) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL30937768 0.77 MAPT (0.34) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL30640462 0.77 MAPT (0.42) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL21505452 0.77 MAPT (0.42) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL20562476 0.77 POLB (0.42) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL16048277 0.77 MAPT (0.34) MAPTKDM4EALDH1A1HTTGAA
SCHEMBL29352476 0.76 KDM4E (0.45) MAPTKDM4EALDH1A1HTTGAA

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-1362854-B1 Benzo[b[thiophene derivatives and process for producing the same TEIJIN PHARMA LTD (JP) 2007-10-31 EP disclosed