SCHEMBL6870957

SCHEMBL6870957

CCOCCn1cc(C2CCN(CCCC(O)c3cccc(C)c3)CC2)c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 18/20 0.61
HTR2A P28223 4/20 0.57
HTR2C P28335 4/20 0.57
HTR2B P41595 4/20 0.57

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
SCHEMBL7154548 0.92 HRH2 (0.51) HRH2HTR2AHTR2CHTR2B
SCHEMBL7703139 0.90 HRH2 (0.50) HRH2HTR2AHTR2CHTR2B
SCHEMBL7159246 0.83 DRD2 (0.49) HRH2HTR2AHTR2CHTR2B
SCHEMBL27581330 0.82 HRH2 (0.48) HRH2HTR2AHTR2CHTR2B
SCHEMBL6782586 0.82 HRH2 (0.59) HRH2HTR2AHTR2CHTR2B
SCHEMBL6780881 0.78 HRH2 (0.71) HRH2HTR2AHTR2CHTR2B
SCHEMBL6780893 0.77 HRH2 (0.70) HRH2HTR2AHTR2CHTR2B
SCHEMBL6780310 0.77 HRH2 (0.72) HRH2HTR2AHTR2CHTR2B
SCHEMBL6780532 0.77 HRH2 (0.69) HRH2HTR2AHTR2CHTR2B
SCHEMBL7152263 0.77 HRH2 (0.69) HRH2HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003501424-A 2003-01-14 JP claimed
EP-1183251-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS Almirall Prodesfarma, S.A. (ES) 2002-03-06 EP claimed
WO-2000075130-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA, S.A. (ES) 2000-12-14 WO claimed
EP-1183251-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2004-02-11 EP disclosed
EP-1183251-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS Almirall Prodesfarma, S.A. (ES) 2002-03-06 EP disclosed
WO-2000075130-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA, S.A. (ES) 2000-12-14 WO disclosed