SCHEMBL10692266

SCHEMBL10692266

OCCNCCOc1c2ccccc2cc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 3/20 0.63
HTR1D P28221 1/20 0.63
TSHR P16473 4/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C19 P33261 2/20 0.42
POLB P06746 1/20 0.42
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40

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
SCHEMBL11170176 0.88 HTR1B (0.63) HTR1BHTR1DTSHRL3MBTL1SMN1; SMN2
SCHEMBL5115767 0.83 ALDH1A1 (0.47) HTR1BHTR1DL3MBTL1ALDH1A1KDM4E
SCHEMBL10691402 0.80 LMNA (0.54) HTR1BHTR1DTSHRL3MBTL1SMN1; SMN2
SCHEMBL10693763 0.79 ALDH1A1 (0.50) HTR1BHTR1DTSHRL3MBTL1SMN1; SMN2
SCHEMBL11162302 0.79 LMNA (0.52) HTR1BHTR1DTSHRL3MBTL1SMN1; SMN2
SCHEMBL11176181 0.79 TSHR (0.51) HTR1BHTR1DTSHRL3MBTL1SMN1; SMN2
SCHEMBL7877916 0.78 GPR84 (0.47) HTR1BTSHRL3MBTL1ALDH1A1KDM4E
SCHEMBL10692922 0.77 HTR1B (0.56) HTR1BHTR1DCYP1A2CYP2D6CYP2C19
SCHEMBL3297203 0.73 PRMT5 (0.50) HTR1BHTR1DL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL10692155 0.72 SLC2A1 (0.50) HTR1BALDH1A1KDM4EHSD17B10

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