SCHEMBL9504264

SCHEMBL9504264

CCCCSc1cc(C(=O)OC2CCC3CC(Cl)CCC3C2)c(N)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 7/20 0.34
HTR3B O95264 7/20 0.34
HTR3A P46098 7/20 0.34
HTR3D Q70Z44 7/20 0.34
HTR3C Q8WXA8 7/20 0.34
SOAT1 P35610 7/20 0.34
S100A4 P26447 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
FGB P02675 1/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GRK6 P43250 1/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
PKM P14618 1/20 0.32
MAPK1 P28482 1/20 0.32
MCL1 Q07820 1/20 0.32

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
SCHEMBL9504267 1.00 HTR3E (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9501606 0.92 SOAT1 (0.36) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9501609 0.92 SOAT1 (0.36) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9505392 0.92 HTR3E (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9505388 0.92 HTR3E (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9504266 0.91 MAPT (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9504263 0.91 MAPT (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9503220 0.87 SOAT1 (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9503219 0.87 SOAT1 (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9501630 0.87 MAPT (0.36) HTR3EHTR3BHTR3AHTR3DHTR3C

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-0307866-B1 DICHROIC COLORING AGENTS FOR LIQUID CRYSTAL DISPLAYS MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-05-12 EP disclosed