SCHEMBL3633774

SCHEMBL3633774

COc1ccc(C(CCCOc2ccccc2)N2Cc3c(cccc3N3CCN(Cc4ccccc4)CC3)C2=O)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 18/20 0.59
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45

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
SCHEMBL2346840 1.00 UTS2R (0.59) UTS2RDRD2DRD4DRD3
SCHEMBL2346047 0.92 UTS2R (0.68) UTS2R
SCHEMBL2346051 0.88 UTS2R (0.65) UTS2R
SCHEMBL3633753 0.88 UTS2R (0.66) UTS2R
SCHEMBL2341376 0.88 UTS2R (0.66) UTS2R
SCHEMBL2341777 0.85 UTS2R (0.65) UTS2R
SCHEMBL2349470 0.85 UTS2R (0.68) UTS2R
SCHEMBL12157486 0.83 UTS2R (0.64) UTS2R
SCHEMBL2351169 0.82 UTS2R (0.69) UTS2R
SCHEMBL2351051 0.82 UTS2R (0.70) 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-2161994-A2 UROTENSIN II RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2010-03-17 EP disclosed
WO-2008153902-A2 UROTENSIN II RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-12-18 WO disclosed