SCHEMBL13362183

SCHEMBL13362183

O=C(C[C@H]1CCN2C(=O)CCC2C1)Nc1ccc(-c2cc(F)cc(F)c2)cn1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 15/20 0.60
USP30 Q70CQ3 1/20 0.46
DEGS1 O15121 2/20 0.46
WNT3A P56704 1/20 0.41
ABL1 P00519 1/20 0.41

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
SCHEMBL12284422 1.00 NPY5R (0.60) NPY5RUSP30DEGS1WNT3AABL1
SCHEMBL2315190 0.85 NPY5R (0.60) NPY5RUSP30DEGS1ABL1
SCHEMBL2318725 0.85 NPY5R (0.60) NPY5RUSP30DEGS1ABL1
SCHEMBL2315654 0.84 NPY5R (0.61) NPY5RDEGS1
SCHEMBL2417423 0.80 NPY5R (0.49) NPY5RUSP30DEGS1WNT3AABL1
SCHEMBL2417560 0.80 NPY5R (0.49) NPY5RUSP30DEGS1WNT3AABL1
SCHEMBL2417021 0.80 NPY5R (0.49) NPY5RUSP30DEGS1WNT3AABL1
SCHEMBL2320672 0.79 WNT3A (0.53) NPY5RUSP30DEGS1WNT3AABL1
SCHEMBL2318660 0.77 NPY5R (0.52) NPY5RUSP30DEGS1ABL1
SCHEMBL399950 0.77 NPY5R (0.89) NPY5RDEGS1ABL1

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-2010053861-A2 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2010-05-14 WO disclosed