SCHEMBL9818808

SCHEMBL9818808

CC(OC(c1ccccc1)c1ccccc1)N1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 8/20 0.53
CYP1A2 P05177 6/20 0.53
CYP3A4 P08684 6/20 0.53
CYP2C19 P33261 6/20 0.53
KCNH2 Q12809 6/20 0.53
CYP2C9 P11712 4/20 0.53
KCNA5 P22460 4/20 0.53
KCNE1 P15382 1/20 0.53
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
TSHR P16473 2/20 0.45
GAA P10253 1/20 0.45
CHRNA7 P36544 1/20 0.42
MAOB P27338 1/20 0.41
MC4R P32245 1/20 0.41
CHRM2 P08172 2/20 0.40
HTR1A P08908 2/20 0.40
ADRA2A P08913 2/20 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
SCHEMBL10339412 0.83 ACHE (0.43) CYP2D6CYP1A2CYP2C19KCNH2CYP2C9
SCHEMBL6255523 0.83 MEN1 (0.56) CYP2D6KCNH2MEN1KMT2ACHRM2
SCHEMBL9818778 0.81 CYP2D6 (0.42) CYP2D6CYP1A2CYP3A4CYP2C19KCNH2
SCHEMBL9818776 0.81 OPRD1 (0.52) CYP2D6CYP1A2CYP3A4CYP2C19KCNH2
SCHEMBL6186552 0.76 CYP1A2 (0.46) CYP2D6CYP1A2CYP3A4CYP2C19KCNH2
SCHEMBL6617339 0.76 CYP2D6 (0.42) CYP2D6CYP1A2CYP3A4CYP2C19KCNH2
SCHEMBL2631769 0.75 CYP2D6 (0.79) CYP2D6CYP1A2CYP3A4CYP2C19KCNH2
SCHEMBL20191913 0.75 CYP2D6 (0.79) CYP2D6CYP1A2CYP3A4CYP2C19KCNH2
SCHEMBL1406105 0.75 CYP2D6 (0.79) CYP2D6CYP1A2CYP3A4CYP2C19KCNH2
SCHEMBL9870097 0.75 SRD5A2 (0.36) CYP2D6LMNAMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0259227-B1 BENZHYDRYLOXYETHYL PIPERIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Société anonyme: LES LABORATOIRES MERAM (FR) 1991-12-27 EP claimed
US-4983614-A ANTISPASMODIC, ANTIALLERGENIC AND ANTIHISTAMINE AGENTS LES LABORATOIRES MERAM (FR) 1991-01-08 US claimed
EP-0259227-A1 Benzhydryloxyethyl piperidine derivatives, process for their preparation and pharmaceutical compositions containing them Société anonyme: LES LABORATOIRES MERAM (FR) 1988-03-09 EP claimed
EP-0259227-B1 BENZHYDRYLOXYETHYL PIPERIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Société anonyme: LES LABORATOIRES MERAM (FR) 1991-12-27 EP disclosed
EP-0259227-B1 BENZHYDRYLOXYETHYL PIPERIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Société anonyme: LES LABORATOIRES MERAM (FR) 1991-12-27 EP disclosed
US-4983614-A ANTISPASMODIC, ANTIALLERGENIC AND ANTIHISTAMINE AGENTS LES LABORATOIRES MERAM (FR) 1991-01-08 US disclosed
US-4983614-A ANTISPASMODIC, ANTIALLERGENIC AND ANTIHISTAMINE AGENTS LES LABORATOIRES MERAM (FR) 1991-01-08 US disclosed
US-4983614-A ANTISPASMODIC, ANTIALLERGENIC AND ANTIHISTAMINE AGENTS LES LABORATOIRES MERAM (FR) 1991-01-08 US disclosed
EP-0259227-A1 Benzhydryloxyethyl piperidine derivatives, process for their preparation and pharmaceutical compositions containing them Société anonyme: LES LABORATOIRES MERAM (FR) 1988-03-09 EP disclosed
EP-0259227-A1 Benzhydryloxyethyl piperidine derivatives, process for their preparation and pharmaceutical compositions containing them Société anonyme: LES LABORATOIRES MERAM (FR) 1988-03-09 EP disclosed
EP-0259227-A1 Benzhydryloxyethyl piperidine derivatives, process for their preparation and pharmaceutical compositions containing them Société anonyme: LES LABORATOIRES MERAM (FR) 1988-03-09 EP disclosed