SCHEMBL8943795

SCHEMBL8943795

c1cc(Nc2cccc3ccccc23)c(Nc2cccc3ccccc23)c(OCCCCCCCCOc2cccc(Nc3cccc4ccccc34)c2Nc2cccc3ccccc23)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.50
KCNA3 P22001 1/20 0.50
HRH1 P35367 1/20 0.48
HTR1B P28222 10/20 0.47
HTR1D P28221 2/20 0.45
HRH3 Q9Y5N1 4/20 0.45
HTR2A P28223 2/20 0.45
HTR7 P34969 2/20 0.45
HTR6 P50406 2/20 0.45
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
CDC25B P30305 1/20 0.45
ATM Q13315 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NR2E1 Q9Y466 1/20 0.44
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL8943921 0.85 KCNA3 (0.44) SLC6A4KCNA3HRH1HTR1BHTR1D
SCHEMBL8943979 0.82 CDC25B (0.51) SLC6A4ALDH1A1CDC25BHSD17B10TDP1
SCHEMBL8943787 0.78 FADS1 (0.49) SLC6A4KCNA3HRH1HTR1BHRH3
SCHEMBL16902853 0.76 KCNA3 (0.79) SLC6A4KCNA3HRH1HTR1BHTR1D
SCHEMBL16902854 0.76 KCNA3 (0.79) SLC6A4KCNA3HRH1HTR1BHTR1D
SCHEMBL16902855 0.76 KCNA3 (0.79) SLC6A4KCNA3HRH1HTR1BHTR1D
SCHEMBL16902840 0.76 KCNA3 (0.79) SLC6A4KCNA3HRH1HTR1BHTR1D
SCHEMBL16902852 0.76 KCNA3 (0.79) SLC6A4KCNA3HRH1HTR1BHTR1D
SCHEMBL16902849 0.76 KCNA3 (0.79) SLC6A4KCNA3HRH1HTR1BHTR1D
SCHEMBL16902863 0.76 KCNA3 (0.79) SLC6A4KCNA3HRH1HTR1BHTR1D

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-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed