SCHEMBL9020873

SCHEMBL9020873

O=CC1CCN(CCOC(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.59
SLC6A4 P31645 3/20 0.57
SLC6A3 Q01959 3/20 0.57
TP53 P04637 2/20 0.57
CYP1A2 P05177 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C9 P11712 2/20 0.57
TSHR P16473 2/20 0.57
MAPK1 P28482 2/20 0.57
CYP2C19 P33261 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
MAPT P10636 1/20 0.57
ALOX15 P16050 1/20 0.57
NFKB1 P19838 1/20 0.57
SLC6A2 P23975 1/20 0.57
THPO P40225 1/20 0.57
MTOR P42345 1/20 0.57
RAB9A P51151 1/20 0.57
HIF1A Q16665 1/20 0.57
HSD17B10 Q99714 1/20 0.57

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
SCHEMBL9021174 0.93 SLC6A2 (0.67) SIGMAR1SLC6A4SLC6A3CYP1A2CYP2D6
SCHEMBL9020983 0.86 SIGMAR1 (0.61) SIGMAR1SLC6A4SLC6A3SLC6A2
SCHEMBL9022573 0.84 SLC6A4 (0.58) SIGMAR1SLC6A4SLC6A3CYP1A2CYP2D6
SCHEMBL10357800 0.83 SIGMAR1 (0.81) SIGMAR1SLC6A4SLC6A3TP53CYP1A2
SCHEMBL14198311 0.81 SIGMAR1 (0.64) SIGMAR1SLC6A4SLC6A3TP53CYP1A2
SCHEMBL9020789 0.81 SLC6A4 (0.61) SIGMAR1SLC6A4SLC6A3SLC6A2
SCHEMBL13960252 0.80 KCNA3 (0.65) SIGMAR1CYP2D6
SCHEMBL4048093 0.79 SIGMAR1 (0.42) SIGMAR1SLC6A4SLC6A3SLC6A2
SCHEMBL4048099 0.79 SIGMAR1 (0.42) SIGMAR1SLC6A4SLC6A3SLC6A2
SCHEMBL9021099 0.79 CYP3A4 (0.66) SIGMAR1SLC6A4SLC6A3CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0470686-B1 (Benzhydryloxyethylpiperidyl)aliphatic acid derivatives and their use in the treatment of allergies and asthma SANKYO CO (JP) 1996-05-15 EP disclosed
US-5294623-A (Benzhydryloxyethylpiperidyl) aliphatic acid derivatives and their use in the treatment of allergies and asthma SANKYO COMPANY, LIMITED (JP) 1994-03-15 US disclosed
EP-0470686-A2 (Benzhydryloxyethylpiperidyl)aliphatic acid derivatives and their use in the treatment of allergies and asthma Sankyo Company Limited (JP) 1992-02-12 EP disclosed