SCHEMBL5345189

SCHEMBL5345189

O=C(O)c1cc(CN2CCC(c3cn(Cc4ccncc4)c4ccccc34)CC2)ccc1F

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 10/20 0.70
HTR2A P28223 6/20 0.59
HTR2C P28335 6/20 0.59
HTR2B P41595 6/20 0.59
DRD2 P14416 1/20 0.49
HTR6 P50406 1/20 0.49

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
SCHEMBL5354833 0.91 HRH2 (0.67) HRH2HTR2AHTR2CHTR2BDRD2
SCHEMBL5345961 0.88 HRH2 (0.68) HRH2HTR2AHTR2CHTR2B
SCHEMBL5348386 0.87 HRH2 (0.77) HRH2HTR2AHTR2CHTR2B
SCHEMBL5350367 0.85 HRH2 (0.71) HRH2HTR2AHTR2CHTR2B
SCHEMBL5350866 0.85 HRH2 (0.75) HRH2HTR2AHTR2CHTR2BDRD2
SCHEMBL5340547 0.83 HRH2 (0.73) HRH2HTR2AHTR2CHTR2B
SCHEMBL5355621 0.82 HRH2 (0.71) HRH2HTR2AHTR2CHTR2B
SCHEMBL5350493 0.79 HRH2 (0.69) HRH2HTR2AHTR2CHTR2BDRD2
SCHEMBL5350397 0.78 HTR2A (0.74) HRH2HTR2AHTR2CHTR2B
SCHEMBL5348667 0.78 HTR2A (0.76) HRH2HTR2AHTR2CHTR2BDRD2

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