SCHEMBL10973045

SCHEMBL10973045

COc1ccc2cc3ccc(C)cc3c(OCCCCCCl)c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
HPGD P15428 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
PLA2G2A P14555 1/20 0.35
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC2A1 P11166 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
CYP17A1 P05093 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
PPARG P37231 1/20 0.34
KCNA3 P22001 3/20 0.34
KCNA5 P22460 2/20 0.34

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
SCHEMBL10695867 0.88 HASPIN (0.40) MTNR1APLA2G2AMAPTSLC2A1HTR1A
SCHEMBL10693321 0.86 CYP1A2 (0.44) MTNR1AMTNR1BHPGDL3MBTL1MAPT
SCHEMBL10692825 0.86 MAOB (0.46) TDP1HTR1ACYP1A2
SCHEMBL10691148 0.83 MAOA (0.49) HPGDMAPTACHECYP1A2
SCHEMBL10691598 0.78 HPGD (0.50) HPGDL3MBTL1MAPTTDP1LMNA
SCHEMBL10692377 0.77 L3MBTL1 (0.40) HPGDL3MBTL1MAPTTDP1SLC2A1
SCHEMBL10688006 0.77 CYP1A2 (0.45) MTNR1AMTNR1BL3MBTL1MAPTTDP1
SCHEMBL14884628 0.75 HASPIN (0.55) HPGDL3MBTL1MAPTTDP1LMNA
SCHEMBL10688770 0.75 CYP1A2 (0.42) MTNR1APPARGCYP1A2CYP2A6CLK1
SCHEMBL10694029 0.73 HTR2A (0.49) CYP1A2CYP2A6

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-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