SCHEMBL14775839

SCHEMBL14775839

Cc1nn(C2CCOCC2)c2sc(C(=O)N[C@H]3CC[C@@H](N4CCN(C(=O)O)C(C(C)(C)C)C4)CC3)cc12

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 20/20 0.72

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
SCHEMBL14775711 1.00 PDE7A (0.72) PDE7A
SCHEMBL14775893 0.92 PDE7A (0.71) PDE7A
SCHEMBL14775101 0.92 PDE7A (0.71) PDE7A
SCHEMBL853925 0.88 PDE7A (0.87) PDE7A
SCHEMBL855139 0.88 PDE7A (0.87) PDE7A
SCHEMBL853924 0.88 PDE7A (0.87) PDE7A
SCHEMBL14775845 0.87 PDE7A (0.66) PDE7A
SCHEMBL14775660 0.86 PDE7A (0.70) PDE7A
SCHEMBL853980 0.84 PDE7A (1.00) PDE7A
SCHEMBL853981 0.84 PDE7A (1.00) PDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1775298-B1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY DAIICHI SANKYO CO LTD (JP) 2013-03-20 EP claimed