SCHEMBL28056262

SCHEMBL28056262

CCOC(=O)C(N)CCCNC(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 3/20 0.59
DPP7 Q9UHL4 3/20 0.59
SLC1A3 P43003 1/20 0.58
SLC1A1 P43005 1/20 0.58
HTT P42858 1/20 0.58
ANPEP P15144 1/20 0.57
DPP4 P27487 2/20 0.55
DPP9 Q86TI2 2/20 0.55
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TGM2 P21980 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.51
KEAP1 Q14145 2/20 0.51
NFE2L2 Q16236 2/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51

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
SCHEMBL19882162 1.00 DPP8 (0.59) DPP8DPP7SLC1A3SLC1A1HTT
SCHEMBL23542526 0.96 DPP8 (0.64) DPP8DPP7SLC1A3SLC1A1HTT
SCHEMBL10917494 0.96 DPP8 (0.64) DPP8DPP7SLC1A3SLC1A1HTT
Hydrochloric Acid SCHEMBL27139143 0.95 DPP8 (0.63) DPP8DPP7SLC1A3SLC1A1HTT
Hydrochloric Acid SCHEMBL11023028 0.95 DPP8 (0.63) DPP8DPP7SLC1A3SLC1A1HTT
SCHEMBL9656664 0.92 DPP8 (0.64) DPP8DPP7SLC1A3SLC1A1HTT
SCHEMBL1586581 0.90 DPP8 (0.61) DPP8DPP7SLC1A3SLC1A1HTT
SCHEMBL12619410 0.90 DPP8 (0.61) DPP8DPP7SLC1A3SLC1A1HTT
SCHEMBL1586583 0.90 DPP8 (0.61) DPP8DPP7SLC1A3SLC1A1HTT
Hydrochloric Acid SCHEMBL28567293 0.89 DPP8 (0.60) DPP8DPP7SLC1A3SLC1A1HTT

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
CN-105693597-A New inhibitors of cyclophilins and uses thereof 国家健康与医学研究院(INSERM) 2016-06-22 CN disclosed
CN-102811998-B Novel cyclophilin inhibitors and uses thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2016-03-30 CN disclosed