SCHEMBL2201252

SCHEMBL2201252

Cc1nnc(N2CCCC(NC(=O)O)C2)n(Cc2cc(F)ccc2Cl)c1=O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.57
FAP Q12884 2/20 0.48
CYP3A4 P08684 1/20 0.40
FAAH O00519 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40

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
SCHEMBL2200504 0.90 DPP4 (0.57) DPP4FAPCYP3A4FAAHCNR1
SCHEMBL2020035 0.90 DPP4 (0.54) DPP4FAP
SCHEMBL2020037 0.90 DPP4 (0.54) DPP4FAP
SCHEMBL2201273 0.87 DPP4 (0.76) DPP4FAPCYP3A4
SCHEMBL2024037 0.85 DPP4 (0.77) DPP4FAP
SCHEMBL2024039 0.85 DPP4 (0.77) DPP4FAP
SCHEMBL5426211 0.82 DPP4 (0.53) DPP4FAPCYP3A4
SCHEMBL2024583 0.80 DPP4 (0.54) DPP4
SCHEMBL2024582 0.80 DPP4 (0.54) DPP4
SCHEMBL2181463 0.79 DPP4 (0.61) DPP4CYP3A4

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
CN-102791701-A 3- (3-aminopiperidin-1-yl) -5-oxo-1, 2, 4-triazine derivatives as dipeptidyl peptidase IV (DPP-IV) inhibitors CHINA SHANGHAI FOCHON PHARMACEUTICAL CO LTD 2012-11-21 CN disclosed
EP-2521721-A1 3-(3-AMINOPIPERIDIN-1-YL)-5-OXO-1,2,4-TRIAZINE DERIVATES AS DIPEPTIDYL PEPTIDASE IV(DPP-IV) INHIBITORS Shanghai Fochon Pharmaceutical Co. Ltd (CN) 2012-11-14 EP disclosed
WO-2011079778-A1 3-(3-AMINOPIPERIDIN-1-YL)-5-OXO-1,2,4-TRIAZINE DERIVATES AS DIPEPTIDYL PEPTIDASE IV(DPP-IV) INHIBITORS CHINA SHANGHAI FOCHON PHARMACEUTICAL CO LTD (CN) 2011-07-07 WO disclosed