SCHEMBL19250180

SCHEMBL19250180

Ic1cccc(-c2ncc(-c3cccnc3)[nH]2)c1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 15/20 0.63
HPGDS O60760 4/20 0.58
CYP2A6 P11509 1/20 0.53

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
SCHEMBL18122017 0.82 NPY5R (0.89) NPY5RHPGDSCYP2A6
SCHEMBL27832173 0.82 NPY5R (0.63) NPY5RHPGDSCYP2A6
SCHEMBL27815625 0.81 NPY5R (0.87) NPY5RHPGDSCYP2A6
SCHEMBL27832170 0.79 NPY5R (0.71) NPY5RHPGDS
SCHEMBL21466399 0.79 NPY5R (0.61) NPY5RHPGDSCYP2A6
SCHEMBL18120007 0.79 NPY5R (0.68) NPY5RHPGDSCYP2A6
SCHEMBL19198973 0.79 NPY5R (0.61) NPY5RHPGDSCYP2A6
SCHEMBL5077838 0.77 CYP2A6 (0.62) CYP2A6
SCHEMBL19390541 0.76 CYP2A6 (0.64) NPY5RHPGDSCYP2A6
SCHEMBL27832174 0.76 NPY5R (0.67) NPY5RHPGDSCYP2A6

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
WO-2017136403-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2017-08-10 WO disclosed