SCHEMBL10692528

SCHEMBL10692528

CN(C)CCOc1c2ccc(Cl)cc2cc2cc(Cl)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
KDM4E B2RXH2 5/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
NR4A2 P43354 2/20 0.45
ACHE P22303 2/20 0.43
HRH3 Q9Y5N1 2/20 0.43
MLNR O43193 1/20 0.43
NR1I2 O75469 1/20 0.43
ESR1 P03372 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CHRM1 P11229 1/20 0.43
DRD2 P14416 1/20 0.43
GABRA1 P14867 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 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
SCHEMBL10692973 0.80 S1PR4 (0.34) GAANR4A2CYP1A2
SCHEMBL10693760 0.79 HRH3 (0.43) MAPTKDM4EHRH3SLC6A4ALDH1A1
SCHEMBL10694803 0.78 PARP1 (0.42) KDM4EHTR1B
SCHEMBL10692306 0.78 HTR1B (0.60) KDM4ECHRNB2CHRNA4HTR1BALDH1A1
SCHEMBL10690312 0.76 HTR1B (0.51) KDM4ESLC6A4HTR1BCYP1A2
SCHEMBL3563997 0.75 ADRA2A (0.50) MAPTKDM4EGAAMAPK1NR4A2
SCHEMBL10693171 0.74 SLC6A4 (0.35) GAAMAPK1HTR1ADRD2DRD4
SCHEMBL10691905 0.73 L3MBTL1 (0.41) MAPTHTR2AKCNH2HTR1BCYP1A2
SCHEMBL10695347 0.72 HTR1B (0.47) HTR2AHTR1B
SCHEMBL3563207 0.72 HTR7 (0.60) MAPTNR4A2ACHEHTR1AADRA2A

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-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0132351-A2 9-Anthryloxyaminoalkanes and related compounds, processes for their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-01-30 EP disclosed