SCHEMBL8952247

SCHEMBL8952247

Cc1cc2oc3cc(Cl)c(Cl)cc3c2cc1Cl

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 9/20 0.73
PTPN1 P18031 1/20 0.42
MCL1 Q07820 1/20 0.42
CD44 P16070 1/20 0.39
ALDH1A1 P00352 3/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL6466778 0.95 AHR (0.73) AHRPTPN1MCL1CD44ALDH1A1
SCHEMBL13672099 0.91 AHR (0.73) AHRPTPN1MCL1ALDH1A1TSHR
SCHEMBL29403123 0.85 AHR (1.00) AHRNPSR1
SCHEMBL548471 0.85 AHR (1.00) AHRNPSR1
SCHEMBL14033698 0.83 PTPN1 (0.56) AHRPTPN1MCL1ALDH1A1RAB9A
SCHEMBL6466427 0.77 AHR (0.76) AHR
SCHEMBL9927891 0.75 AHR (0.46) AHRMCL1ALDH1A1RAB9ANPC1
SCHEMBL6466410 0.74 AHR (0.70) AHRMCL1CSNK2A2CSNK2BCSNK2A1
SCHEMBL6468968 0.72 AHR (0.60) AHRMCL1
SCHEMBL22019093 0.72 AHR (0.49) AHRALDH1A1MEN1KMT2AMAPT

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-5516790-A Synthesis and application of alkyl-substituted dibenzofurans as antitumorigenic agents TEXAS A&M UNIVERSITY SYSTEM TECHNOLOGY LICENSING OFFICE (US) 1996-05-14 US disclosed