SCHEMBL3392482

SCHEMBL3392482

CN(C)C(=O)N1CC2CC(NCC(=O)N3CCCC3C#N)(C3CCCC3)CC2C1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.77
DPP8 Q6V1X1 5/20 0.77
DPP9 Q86TI2 5/20 0.77
PREP P48147 1/20 0.46

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
SCHEMBL3765962 1.00 DPP4 (0.77) DPP4DPP8DPP9PREP
SCHEMBL13057151 1.00 DPP4 (0.77) DPP4DPP8DPP9PREP
Cadaverine Tartrate SCHEMBL3757841 0.94 DPP4 (0.68) DPP4DPP8DPP9PREP
Cadaverine Tartrate SCHEMBL3392853 0.94 DPP4 (0.68) DPP4DPP8DPP9PREP
SCHEMBL18098617 0.87 DPP4 (0.58) DPP4DPP8DPP9
SCHEMBL18098616 0.87 DPP4 (1.00) DPP4DPP8DPP9PREP
SCHEMBL3395111 0.87 DPP4 (1.00) DPP4DPP8DPP9PREP
SCHEMBL13000686 0.87 DPP4 (1.00) DPP4DPP8DPP9PREP
SCHEMBL3759440 0.87 DPP4 (1.00) DPP4DPP8DPP9PREP
SCHEMBL13000689 0.87 DPP4 (1.00) DPP4DPP8DPP9PREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2246347-B1 DICYCLOAZAALKANE DERIVATES, PREPARATION PROCESSES AND MEDICAL USES THEREOF SHANGHAI HENGRUI PHARM CO LTD (CN) 2016-09-28 EP disclosed
EP-2246347-A1 DICYCLOAZAALKANE DERIVATES, PREPARATION PROCESSES AND MEDICAL USES THEREOF Shanghai Hengrui Pharmaceutical Co. Ltd. (CN) 2010-11-03 EP disclosed