SCHEMBL5352704

SCHEMBL5352704

CCOC(=O)N1CCC(c2cn(Cc3ccoc3)c3ccccc23)CC1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.61
HTR2C P28335 5/20 0.61
HTR2B P41595 5/20 0.61
HRH2 P25021 8/20 0.50
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SLC2A1 P11166 1/20 0.45
MEN1 O00255 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
DRD2 P14416 1/20 0.44
HTR6 P50406 1/20 0.44
KDM4E B2RXH2 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
SCHEMBL5354709 0.87 HRH2 (0.64) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL4054407 0.87 HTR2A (0.47) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5350384 0.86 HTR2A (0.57) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL4054294 0.85 HTR2A (0.49) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5344670 0.84 ALDH1A1 (0.49) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5347587 0.83 CYP1A2 (0.50) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5349348 0.83 HRH2 (0.60) HTR2AHTR2CHTR2BHRH2SMN1; SMN2
SCHEMBL14559252 0.83 KDM4E (0.51) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5340905 0.82 CNR1 (0.52) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5344746 0.82 HRH2 (0.60) HTR2AHTR2CHTR2BHRH2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189741-B2 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA S.A. (ES) 2007-03-13 US disclosed
EP-1330453-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2006-03-29 EP disclosed
US-20040116471-A1 Indolylpiperidine derivatives as antihistaminic aand antiallergic agents ALMIRALL PRODESFARMA S.A. (ES) 2004-06-17 US disclosed
EP-1330453-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS Almirall Prodesfarma, S.A. (ES) 2003-07-30 EP disclosed
WO-2002036589-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA S.A. (ES) 2002-05-10 WO disclosed