SCHEMBL5748447

SCHEMBL5748447

CCOCCn1cc(C2CCNCC2)c2ccncc21

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 16/20 0.43
HTR2A P28223 4/20 0.43
HTR2C P28335 4/20 0.43
HTR2B P41595 4/20 0.43
NFATC1 O95644 2/20 0.42
GSK3B P49841 2/20 0.42
DYRK1A Q13627 2/20 0.42

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
SCHEMBL5749097 0.85 CNR2 (0.41) HRH2HTR2AHTR2CHTR2BNFATC1
SCHEMBL4058347 0.84 HRH2 (0.58) HRH2HTR2AHTR2CHTR2B
SCHEMBL5750985 0.82 HRH2 (0.53) HRH2HTR2AHTR2CHTR2B
SCHEMBL4055816 0.81 HRH2 (0.50) HRH2HTR2AHTR2CHTR2B
SCHEMBL13768719 0.80 HRH2 (0.58) HRH2HTR2AHTR2CHTR2B
SCHEMBL5748984 0.79 HRH2 (0.48) HRH2HTR2AHTR2CHTR2B
SCHEMBL12975604 0.78 APP (0.50) HTR2CNFATC1GSK3BDYRK1A
SCHEMBL4061658 0.78 HTR2A (0.46) HRH2HTR2AHTR2CHTR2B
SCHEMBL4060778 0.78 HTR2A (0.43) HRH2HTR2AHTR2CHTR2B
SCHEMBL4851778 0.74 DYRK1A (0.50) HRH2NFATC1GSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1497292-B1 AZAINDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2006-06-14 EP disclosed
EP-1497292-A1 AZAINDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS Almirall Prodesfarma, S.A. (ES) 2005-01-19 EP disclosed
WO-2003082867-A1 AZAINDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA S.A. (ES) 2003-10-09 WO disclosed