SCHEMBL5347772

SCHEMBL5347772

C1=C(OCCCn2cc(C3CCNCC3)c3ccccc32)OC(Cc2ccccc2)O1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.41
DRD2 P14416 2/20 0.41
HRH2 P25021 7/20 0.39
HTR2A P28223 3/20 0.37
HTR2C P28335 3/20 0.37
HTR2B P41595 3/20 0.37
HTR1A P08908 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
SMO Q99835 1/20 0.36

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
SCHEMBL5347596 0.95 HRH2 (0.41) HTR6DRD2HRH2HTR2AHTR2C
SCHEMBL5345751 0.83 HRH2 (0.47) HTR6DRD2HRH2HTR2AHTR2C
SCHEMBL5345679 0.80 HRH2 (0.69) HTR6DRD2HRH2HTR2AHTR2C
SCHEMBL5348368 0.80 HRH2 (0.65) HTR6DRD2HRH2HTR2AHTR2C
SCHEMBL5348252 0.78 HRH2 (0.49) HRH2HTR2AHTR2CHTR2B
SCHEMBL5345520 0.78 HRH2 (0.65) HTR6DRD2HRH2HTR2AHTR2C
SCHEMBL5346738 0.78 HRH2 (0.65) HTR6DRD2HRH2HTR2AHTR2C
SCHEMBL5344785 0.76 HRH2 (0.69) HTR6DRD2HRH2HTR2AHTR2C
SCHEMBL4055511 0.72 HRH2 (0.53) HTR6HRH2HTR2AHTR2CHTR2B
SCHEMBL4701463 0.72 SLC6A2 (0.53) HTR6HTR2CHTR1ASLC6A2SLC6A4

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