SCHEMBL14018587

SCHEMBL14018587

CN(C(=O)Nc1ccc(-c2cc(F)ccc2F)nc1)C1CCN(C(=O)C2CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.44
NPY5R Q15761 2/20 0.44
CCR5 P51681 1/20 0.43
EPHX2 P34913 1/20 0.41
NAMPT P43490 1/20 0.40
KIF11 P52732 1/20 0.40
ABL1 P00519 3/20 0.39
GSK3B P49841 3/20 0.39
DYRK1A Q13627 2/20 0.39
KDM4A O75164 1/20 0.39
RIN1 Q13671 1/20 0.39
MAPT P10636 2/20 0.39
TACR1 P25103 1/20 0.38
TACR3 P29371 1/20 0.38
CYP11B2 P19099 1/20 0.38

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
SCHEMBL14332398 0.91 KIF11 (0.48) USP30NPY5RCCR5KIF11MAPT
SCHEMBL14019254 0.91 NPY5R (0.48) USP30NPY5RCCR5EPHX2
SCHEMBL14332397 0.89 NPY5R (0.48) USP30NPY5RCCR5EPHX2NAMPT
SCHEMBL14018463 0.88 GSK3B (0.44) USP30NPY5RKIF11ABL1GSK3B
SCHEMBL14332109 0.87 NPY5R (0.54) USP30NPY5RCCR5EPHX2NAMPT
SCHEMBL14019175 0.87 NPY5R (0.50) USP30NPY5RCCR5EPHX2KIF11
SCHEMBL14332274 0.86 USP30 (0.52) USP30MAPT
SCHEMBL14332314 0.86 NPY5R (0.62) USP30NPY5RCCR5CYP11B2
SCHEMBL14332116 0.85 NPY5R (0.52) USP30NPY5RCCR5EPHX2NAMPT
SCHEMBL14332258 0.85 NPY5R (0.52) USP30NPY5RCCR5EPHX2GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1343503-B1 HETEROARYL UREA NEUROPEPTIDE Y Y5 RECEPTOR ANTAGONISTS SCHERING CORP (US) 2008-11-12 EP disclosed
US-7309704-B2 Heteroaryl urea neuropeptide Y Y5 receptor antagonists SCHERING CORPORATION (US) 2007-12-18 US disclosed
US-7309704-B2 Heteroaryl urea neuropeptide Y Y5 receptor antagonists SCHERING CORPORATION (US) 2007-12-18 US disclosed