SCHEMBL5340905

SCHEMBL5340905

CCOC(=O)N1CCC(c2cn(Cc3cccnc3)c3ccccc23)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.52
CNR2 P34972 1/20 0.52
HRH2 P25021 6/20 0.47
HTR2A P28223 2/20 0.47
HTR2C P28335 2/20 0.47
HTR2B P41595 2/20 0.47
ALDH1A1 P00352 3/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
DRD2 P14416 1/20 0.45
HTR6 P50406 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SMO Q99835 1/20 0.44
SLC2A1 P11166 1/20 0.44
APP P05067 1/20 0.43
SNCA P37840 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GABRA1 P14867 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
SCHEMBL5344670 0.89 ALDH1A1 (0.49) CNR1CNR2HRH2HTR2AHTR2C
SCHEMBL5347587 0.83 CYP1A2 (0.50) HRH2HTR2AHTR2CHTR2BALDH1A1
SCHEMBL14559252 0.83 KDM4E (0.51) HRH2HTR2AHTR2CHTR2BALDH1A1
SCHEMBL7088762 0.83 CNR2 (0.49) CNR1CNR2ALDH1A1TSHRLMNA
SCHEMBL5352704 0.82 HTR2A (0.61) HRH2HTR2AHTR2CHTR2BALDH1A1
SCHEMBL6784820 0.80 KDM4E (0.48) CNR1HRH2HTR2AHTR2CHTR2B
SCHEMBL4054407 0.79 HTR2A (0.47) HRH2HTR2AHTR2CHTR2BALDH1A1
SCHEMBL5349348 0.79 HRH2 (0.60) HRH2HTR2AHTR2CHTR2BTSHR
SCHEMBL5344746 0.79 HRH2 (0.60) HRH2HTR2AHTR2CHTR2BALDH1A1
SCHEMBL4063089 0.78 HRH2 (0.55) HRH2HTR2AHTR2CHTR2BALDH1A1

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