SCHEMBL6184510

SCHEMBL6184510

CN(C)CCCCOc1ccccc1CCc1cc(CCN)cc(CCC(=O)O)c1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
HRH1 P35367 3/20 0.48
LTB4R Q15722 1/20 0.46
LTB4R2 Q9NPC1 1/20 0.46

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
SCHEMBL6185574 0.97 HRH1 (0.52) KDM4EHRH1LTB4RLTB4R2
SCHEMBL6183446 0.94 HRH1 (0.51) KDM4EHRH1
SCHEMBL6186059 0.92 HRH1 (0.51) KDM4EHRH1LTB4RLTB4R2
SCHEMBL6185364 0.83 KDM4E (0.46) KDM4EHRH1
SCHEMBL6185286 0.80 HRH1 (0.46) KDM4EHRH1
SCHEMBL6184959 0.79 ALDH1A1 (0.50) HRH1
SCHEMBL6182528 0.79 TBXA2R (0.57)
SCHEMBL11253611 0.79 HRH1 (0.68) HRH1
SCHEMBL6184672 0.78 ABCB1 (0.53) KDM4EHRH1
SCHEMBL11254706 0.78 HRH1 (0.67) HRH1

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