SCHEMBL11020751

SCHEMBL11020751

COc1ccccc1-c1c(OC)cccc1OCCCCCCCCCCl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.46
L3MBTL1 Q9Y468 5/20 0.45
TDP1 Q9NUW8 3/20 0.45
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
HSD17B10 Q99714 2/20 0.42
KCNA3 P22001 1/20 0.42
APP P05067 1/20 0.42
MAPT P10636 5/20 0.42
LMNA P02545 1/20 0.41
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
HPGD P15428 3/20 0.39
MAPK1 P28482 1/20 0.39
TOP1 P11387 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL11022671 0.89 SMN1; SMN2 (0.50) L3MBTL1TDP1ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL11019562 0.86 TDP1 (0.47) HTR7L3MBTL1TDP1ALDH1A1SMN1; SMN2
SCHEMBL11019466 0.84 SYK (0.48) HTR7L3MBTL1TDP1ALDH1A1SMN1; SMN2
SCHEMBL11022396 0.84 HTR7 (0.61) HTR7ALDH1A1KDM4E
SCHEMBL9547466 0.81 L3MBTL1 (0.65) L3MBTL1TDP1ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL5659890 0.79 L3MBTL1 (0.67) L3MBTL1TDP1ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL11019468 0.79 MAOB (0.54) HTR7L3MBTL1ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL11018432 0.78 TSHR (0.42) HTR7L3MBTL1TDP1ALDH1A1SMN1; SMN2
SCHEMBL11018477 0.77 L3MBTL1 (0.47) L3MBTL1TDP1KCNA3MAPTLMNA
SCHEMBL11022053 0.76 RAB9A (0.41) HTR7L3MBTL1ALDH1A1SMN1; SMN2KCNA3

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-0157652-A1 2-, 3- And 4-biphenyloxyaminoalkanes and related compounds, their preparation and uses, and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-10-09 EP disclosed