Sugi Predict

Sugi Predict / Compounds / SCHEMBL6201515

SCHEMBL6201515

SCHEMBL6201515

COc1ccc(C)cc1S(=O)(=O)NCCCCC(=O)Nc1nc2c(s1)CCCc1ccc(F)cc1-2.NCCCCC(=O)Nc1nc2c(s1)CCCc1ccc(F)cc1-2

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 19/20 0.51
▸ PI4KB Q9UBF8 1/20 0.44

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
SCHEMBL1593658 0.97 NPY5R (0.54) NPY5RPI4KB
SCHEMBL14408619 0.86 NPY5R (0.70) NPY5R
SCHEMBL6201519 0.85 NPY5R (0.43) NPY5R
SCHEMBL1593364 0.82 NPY5R (0.61) NPY5R
SCHEMBL1594083 0.81 NPY5R (0.76) NPY5R
SCHEMBL14408640 0.81 NPY5R (0.69) NPY5R
SCHEMBL1593661 0.78 NPY5R (0.48) NPY5R
SCHEMBL1595108 0.74 NPY5R (0.61) NPY5R
SCHEMBL5127076 0.74 NPY5R (0.70) NPY5R
SCHEMBL14408682 0.72 NPY5R (0.77) NPY5R

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-1194421-B1 SELECTIVE NPY (Y5) ANTAGONISTS LUNDBECK & CO AS H (DK) 2005-10-12 — — EP disclosed