SCHEMBL27558709

SCHEMBL27558709

ClC(Cl)(Cl)c1cccc2sc3ccccc3c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.50
MAPT P10636 5/20 0.39
MCL1 Q07820 3/20 0.39
MEN1 O00255 2/20 0.39
POLB P06746 2/20 0.39
KMT2A Q03164 2/20 0.39
DUSP3 P51452 1/20 0.39
BLM P54132 1/20 0.39
PTPN5 P54829 1/20 0.39
PTPN11 Q06124 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 4/20 0.37
HPGD P15428 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
TNKS O95271 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35

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
SCHEMBL27541383 0.82 GPR3 (0.52) GPR3MAPTMCL1MEN1POLB
SCHEMBL2388003 0.80 GPR3 (0.56) GPR3MAPTMCL1MEN1POLB
SCHEMBL6489524 0.80 GPR3 (0.50) GPR3MAPTMCL1MEN1POLB
SCHEMBL30490060 0.79 GPR3 (0.54) GPR3MAPTMCL1MEN1POLB
SCHEMBL7226057 0.79 GPR3 (0.54) GPR3MAPTMCL1MEN1POLB
SCHEMBL30800961 0.79 GPR3 (0.54) GPR3MAPTMCL1MEN1POLB
SCHEMBL23057024 0.78 GPR3 (0.48) GPR3MAPTMCL1MEN1POLB
Hydrogen Sulfide SCHEMBL29100291 0.78 GPR3 (0.48) GPR3MAPTMCL1MEN1POLB
SCHEMBL2388504 0.77 GPR3 (0.46) GPR3MAPTMCL1MEN1POLB
SCHEMBL28076011 0.76 GPR3 (0.45) GPR3MAPTMCL1MEN1POLB

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
CN-1294568-A Fluorinating agent, process for producing same, and use thereof MITSUI CHEMICALS INC (JP) 2001-05-09 CN disclosed