SCHEMBL7155502

SCHEMBL7155502

CCCCCn1cc(C2CCN(CCCC(=O)O)CC2)c2ccccc21.COCCOCCn1cc(C2CCN(CCc3ccc(CCC(=O)O)cc3)CC2)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 13/20 0.54
HTR2A P28223 4/20 0.52
HTR2C P28335 4/20 0.52
HTR2B P41595 4/20 0.52

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
SCHEMBL6781027 0.94 HRH2 (0.57) HRH2HTR2AHTR2CHTR2B
SCHEMBL7157954 0.92 HRH2 (0.58) HRH2HTR2AHTR2CHTR2B
SCHEMBL7155507 0.92 HRH2 (0.51) HRH2HTR2AHTR2CHTR2B
SCHEMBL6781730 0.89 HRH2 (0.59) HRH2HTR2AHTR2CHTR2B
SCHEMBL6780865 0.87 HRH2 (0.69) HRH2HTR2AHTR2CHTR2B
SCHEMBL6782119 0.86 HRH2 (0.64) HRH2HTR2AHTR2CHTR2B
SCHEMBL6782099 0.85 HRH2 (0.60) HRH2HTR2AHTR2CHTR2B
SCHEMBL7157958 0.85 HRH2 (0.55) HRH2HTR2AHTR2CHTR2B
SCHEMBL6780881 0.82 HRH2 (0.71) HRH2HTR2AHTR2CHTR2B
SCHEMBL6780018 0.82 HRH2 (0.52) 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 3 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