SCHEMBL5314152

SCHEMBL5314152

NC(=O)c1ccc(-c2ccc(C(=O)N3CCCC3Cn3cccc3)cc2)s1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.46
MET P08581 7/20 0.41
IKBKB O14920 3/20 0.41
CSF1R P07333 2/20 0.41
CPB1 P15086 1/20 0.40
ATR Q13535 1/20 0.40
CHEK2 O96017 1/20 0.38

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
SCHEMBL5314156 1.00 HRH3 (0.46) HRH3METIKBKBCSF1RCPB1
SCHEMBL3204427 0.90 HRH3 (0.54) HRH3METIKBKBCSF1RATR
SCHEMBL3200739 0.90 HRH3 (0.54) HRH3METIKBKBCSF1RATR
SCHEMBL3198036 0.79 HRH3 (0.56) HRH3METIKBKBCSF1RATR
SCHEMBL3196722 0.79 HRH3 (0.54) HRH3METIKBKBCSF1RATR
SCHEMBL3196729 0.79 HRH3 (0.54) HRH3METIKBKBCSF1RATR
SCHEMBL3198018 0.79 HRH3 (0.56) HRH3METIKBKBCSF1RATR
SCHEMBL3196699 0.78 HRH3 (0.57) HRH3METIKBKBCSF1RATR
SCHEMBL3196709 0.78 HRH3 (0.57) HRH3METIKBKBCSF1RATR
SCHEMBL3194658 0.77 HRH3 (0.53) HRH3METIKBKBCSF1RATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784400-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-05-16 EP claimed
WO-2006023462-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-03-02 WO claimed