SCHEMBL4592289

SCHEMBL4592289

CCc1c(N)cc(Cl)c(CC)c1NC(=O)N(c1ccc(NC)cc1)C(C)c1ccc(Cl)cc1.CCc1c(N)cc(Cl)c(CC)c1NC(=O)N(c1ccc(NC)cc1)C(C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 14/20 0.38
NPY5R Q15761 1/20 0.36
PDK1 Q15118 3/20 0.34
CASR P41180 1/20 0.34
PNLIP P16233 1/20 0.34

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
SCHEMBL4592287 1.00 UTS2R (0.38) UTS2RNPY5RPDK1CASRPNLIP
SCHEMBL4592695 0.96 UTS2R (0.35) UTS2R
SCHEMBL4592115 0.96 PDK1 (0.36) NPY5RPDK1
SCHEMBL4592696 0.96 UTS2R (0.35) UTS2R
SCHEMBL5047706 0.96 PDK1 (0.36) NPY5RPDK1
SCHEMBL4592817 0.91 UTS2R (0.38) UTS2R
SCHEMBL4592820 0.91 UTS2R (0.38) UTS2R
SCHEMBL4592462 0.89 UTS2R (0.37) UTS2R
SCHEMBL4592463 0.89 UTS2R (0.37) UTS2R
SCHEMBL4592260 0.87 UTS2R (0.36) UTS2R

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-1885691-A1 C5A RECEPTOR ANTAGONISTS Jerini AG (DE) 2008-02-13 EP claimed
WO-2006128670-A1 C5A RECEPTOR ANTAGONISTS JERINI AG (DE) 2006-12-07 WO claimed