SCHEMBL9633544

SCHEMBL9633544

[CH2]C1c2cc(Cl)ccc2Oc2ccc(Cl)cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.54
HTR2A P28223 6/20 0.46
HTR2C P28335 6/20 0.46
HRH1 P35367 4/20 0.46
ADRA2A P08913 4/20 0.46
DRD2 P14416 3/20 0.46
ADRA2C P18825 3/20 0.46
DRD1 P21728 3/20 0.46
DRD3 P35462 3/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
GABRA1 P14867 1/20 0.46
ADRA2B P18089 1/20 0.46
DRD4 P21917 1/20 0.46
SLC6A2 P23975 1/20 0.46
ADRA1D P25100 1/20 0.46
SLC6A4 P31645 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46
HTR2B P41595 1/20 0.46

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
SCHEMBL9633548 0.78 AHR (0.54) AHRHTR2AHTR2CHRH1ADRA2A
SCHEMBL9631975 0.74 AHR (0.48) AHRHTR2AHTR2CHRH1ADRA2A
SCHEMBL3874189 0.72 AHR (0.47) AHRHTR2AHTR2CHRH1ADRA2A
SCHEMBL1146066 0.72 HTR2C (0.53) AHRHTR2AHTR2CHRH1ADRA2A
SCHEMBL11732034 0.71 MAOA (0.68) AHRHTR2AHTR2CHRH1ADRA2A
SCHEMBL11215846 0.71 AHR (1.00) AHRMAPK1FLT1
SCHEMBL29588977 0.71 AHR (1.00) AHRMAPK1FLT1
SCHEMBL2885125 0.71 AHR (1.00) AHRMAPK1FLT1
SCHEMBL28555079 0.71
SCHEMBL1146208 0.70 DRD2 (0.85) AHRHTR2AHTR2CHRH1ADRA2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5101059-A Xanthene compounds RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1992-03-31 US disclosed
WO-1991008190-A1 AMINO ACID PROTECTING GROUPS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1991-06-13 WO disclosed