SCHEMBL5700612

SCHEMBL5700612

[CH2]CCOCCCc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.55
SLC6A2 P23975 2/20 0.55
HRH1 P35367 2/20 0.55
HRH3 Q9Y5N1 2/20 0.55
CHRM2 P08172 1/20 0.55
ADRA2C P18825 1/20 0.55
SLC6A4 P31645 1/20 0.55
SLC6A3 Q01959 1/20 0.55
CACNA1C Q13936 1/20 0.55
SCN5A Q14524 1/20 0.55
CHRM4 P08173 1/20 0.54
HTR2C P28335 1/20 0.54
HTR7 P34969 1/20 0.54
TMEM97 Q5BJF2 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
HTR3E A5X5Y0 1/20 0.43
HTR3B O95264 1/20 0.43
HTR3A P46098 1/20 0.43
HTR3D Q70Z44 1/20 0.43
HTR3C Q8WXA8 1/20 0.43

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
SCHEMBL9021448 0.94 KCNH2 (0.50) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9021745 0.93 KCNH2 (0.49) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9021231 0.93 KCNH2 (0.49) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9021167 0.93 KCNH2 (0.49) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9154990 0.92 KCNH2 (0.55) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9021407 0.91 KCNH2 (0.54) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9249000 0.90 SLC6A2 (0.64) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9021186 0.89 KCNH2 (0.53) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9021280 0.89 KCNH2 (0.53) KCNH2SLC6A2HRH1HRH3CHRM2
SCHEMBL9021254 0.88 TAAR1 (0.45) KCNH2SLC6A2HRH1HRH3CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024084379-A1 A NOVEL PROCESS FOR THE PREPARATION OF AMORPHOUS SOLID DISPERSION OF 1-{3-[3-(4-CHLOROPHENYL) PROPOXY] PROPYL} PIPERIDINE, HYDROCHLORIDE WITH HYDROXYPROPYL BETA-CYCLODEXTRIN (HPβCD) BIOPHORE INDIA PHARMACEUTICALS PVT. LTD (IN) 2024-04-25 WO disclosed
EP-1690858-A1 Monohydrochloride salt of 1-¬3-¬3-(4-chlorophenyl)propoxy|propyl|-piperidine FERRER INTERNACIONAL, S.A. (ES) 2006-08-16 EP disclosed
EP-0500853-B1 PHENYLETHANOLAMINES, DRUGS CONTAINING THESE COMPOUNDS, AND A METHOD OF PREPARING THEM THOMAE GMBH DR K (DE) 1996-12-27 EP disclosed
US-5393774-A Antispasmodic agents PIEPER HELMUT (DE) 1995-02-28 US disclosed