SCHEMBL10691148

SCHEMBL10691148

CCCN(CCC)CCCCCOc1c2cc(C)ccc2cc2ccc(OC)cc12

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.49
MAOB P27338 2/20 0.49
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ATP4A P20648 1/20 0.37
ATP4B P51164 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL10692825 0.87 MAOB (0.46) MAOAMAOBKDM4EALDH1A1CYP1A2
SCHEMBL10973045 0.83 MTNR1A (0.37) CYP1A2MAPTHPGDACHE
SCHEMBL10695867 0.82 HASPIN (0.40) CYP1A2MAPT
SCHEMBL10694626 0.76 HTR1B (0.49) MAOAMAOBALDH1A1BCHEACHE
SCHEMBL10694029 0.75 HTR2A (0.49) MAOAMAOBKDM4EALDH1A1CYP1A2
SCHEMBL10691598 0.73 HPGD (0.50) MAPTHPGDHSD17B10
SCHEMBL23271665 0.72 SLC2A1 (0.43) CYP1A2GAAMAPT
SCHEMBL23089963 0.72 SLC2A1 (0.43) CYP1A2GAAMAPT
SCHEMBL23089911 0.72 SLC2A1 (0.43) CYP1A2GAAMAPT
SCHEMBL23089927 0.72 SLC2A1 (0.43) CYP1A2GAAMAPT

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-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed