SCHEMBL6185286

SCHEMBL6185286

CN(C)CCCOc1ccccc1CCc1cc(CCC(=O)O)cc(CCN2C(=O)c3ccccc3C2=O)c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.46
KDM4E B2RXH2 1/20 0.42
MAOB P27338 2/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL6185364 0.97 KDM4E (0.46) HRH1KDM4EMAOB
SCHEMBL6187276 0.95 HRH1 (0.45) HRH1KDM4EMAOBTSHR
SCHEMBL6186189 0.95 HRH1 (0.45) HRH1KDM4EMAOBTSHR
SCHEMBL6187569 0.94 HRH1 (0.53) HRH1KDM4EMAOBTSHR
SCHEMBL6184768 0.90 TSHR (0.44) HRH1KDM4EMAOBTSHR
SCHEMBL6182314 0.85 TSHR (0.45) HRH1KDM4EMAOBTSHR
SCHEMBL6185574 0.83 HRH1 (0.52) HRH1KDM4E
SCHEMBL6185121 0.83 ABCB1 (0.49) HRH1KDM4E
SCHEMBL6185078 0.82 PPARG (0.53)
SCHEMBL6185937 0.81 DRD1 (0.51) KDM4EMAOB

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-1275641-B1 Benzenesulfonamide derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-01-12 EP disclosed
US-6541471-B1 Useful as a TXA2 receptor antagonist and a 5-HT2 receptor antagonist LES LABORATOIRES SERVIER (FR) 2003-04-01 US disclosed
EP-1275641-A2 Benzenesulfonamide derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2003-01-15 EP disclosed