SCHEMBL6131871

SCHEMBL6131871

COc1ccc(CN2CCN(c3ccccc3O)CC2)cc1F

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.75
KDM4E B2RXH2 6/20 0.64
GAA P10253 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
MAPK1 P28482 2/20 0.60
HTR7 P34969 2/20 0.59
KMT2A Q03164 2/20 0.57
DRD4 P21917 2/20 0.56
DRD2 P14416 2/20 0.56
DRD3 P35462 1/20 0.56
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53

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
SCHEMBL6132073 0.87 ALDH1A1 (0.66) ALDH1A1KDM4EGAATDP1SMN1; SMN2
SCHEMBL7691290 0.86 ALDH1A1 (0.71) ALDH1A1KDM4EGAATDP1SMN1; SMN2
Hydrochloric Acid SCHEMBL6131815 0.84 ALDH1A1 (0.58) ALDH1A1KDM4EGAATDP1SMN1; SMN2
SCHEMBL6132010 0.79 GAA (0.62) ALDH1A1KDM4EGAATDP1SMN1; SMN2
SCHEMBL9720648 0.79 HTR7 (0.70) ALDH1A1KDM4EGAATDP1SMN1; SMN2
SCHEMBL13559777 0.78 CHKA (0.56) ALDH1A1KDM4ESMN1; SMN2KMT2ADRD4
SCHEMBL21221133 0.78 ALDH1A1 (0.55) ALDH1A1KDM4EGAATDP1SMN1; SMN2
SCHEMBL8325210 0.78 ALDH1A1 (0.63) ALDH1A1GAADRD4HTT
SCHEMBL8327595 0.76 ALDH1A1 (0.66) ALDH1A1GAAMAPK1DRD4LMNA
SCHEMBL6131782 0.76 ALDH1A1 (0.58) ALDH1A1KDM4EGAATDP1SMN1; SMN2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1032559-A4 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2005-05-25 EP claimed
EP-1032559-A1 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2000-09-06 EP claimed
WO-1999016746-A1 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 1999-04-08 WO claimed
EP-1032559-A4 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2005-05-25 EP disclosed
US-6479495-B1 SIMULTANEOUSLY TREATING DEPRESSION AND MEMORY DYSFUNCTION IN MAMMALS SUFFERING FROM MEMORY DYSFUNCTION AND DEPRESSION AVENTIS PHARMACEUTICALS INC. 2002-11-12 US disclosed
EP-1032559-A1 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2000-09-06 EP disclosed
WO-1999016746-A1 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 1999-04-08 WO disclosed