SCHEMBL6509866

SCHEMBL6509866

Cc1nnc(C(=O)C2CCCN2C(=O)CN(C)C2CCCC2)o1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 15/20 0.61
DPP7 Q9UHL4 10/20 0.61
DPP8 Q6V1X1 9/20 0.61
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PKM P14618 1/20 0.40
FAP Q12884 3/20 0.36
PREP P48147 3/20 0.35
POLB P06746 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL6512238 0.99 DPP4 (0.60) DPP4DPP7DPP8LMNARAB9A
SCHEMBL6532165 0.82 DPP4 (0.67) DPP4DPP7DPP8LMNARAB9A
SCHEMBL6530580 0.78 DPP4 (0.82) DPP4DPP7DPP8LMNARAB9A
SCHEMBL6529279 0.75 DPP4 (0.82) DPP4DPP7DPP8LMNARAB9A
SCHEMBL6531039 0.74 DPP4 (0.81) DPP4DPP7DPP8LMNARAB9A
SCHEMBL6529896 0.74 DPP4 (0.59) DPP4DPP7DPP8LMNASMN1; SMN2
SCHEMBL6510510 0.74 DPP4 (0.45) DPP4DPP7DPP8LMNARAB9A
SCHEMBL6531453 0.73 DPP4 (0.65) DPP4DPP7DPP8LMNARAB9A
SCHEMBL6509890 0.69 DPP4 (1.00) DPP4DPP7DPP8FAP
SCHEMBL6528004 0.68 DPP4 (0.69) DPP4DPP7DPP8LMNARAB9A

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-2005037828-A1 NOVEL INHIBITORS OF DPP-IV, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2005-04-28 WO disclosed