SCHEMBL28074283

SCHEMBL28074283

CCC(C)C(N)C(=O)N(C)OC.CCC(C)C(NC)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.35
ENPEP Q07075 2/20 0.34
CA2 P00918 4/20 0.33
CA1 P00915 3/20 0.33
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
FPR2 P25090 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
DPP4 P27487 1/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
ANPEP P15144 1/20 0.31
LNPEP Q9UIQ6 1/20 0.31
FAAH O00519 1/20 0.31
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30

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
SCHEMBL28004804 0.85 DPP4 (0.40) DPP4DPP8DPP9FAAH
SCHEMBL476156 0.85 DPP4 (0.40) DPP4DPP8DPP9FAAH
SCHEMBL2034259 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1
SCHEMBL18560091 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1
SCHEMBL2034664 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1
SCHEMBL203221 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1
SCHEMBL43380 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1
SCHEMBL288609 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1
SCHEMBL203222 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1
SCHEMBL43381 0.76 ALDH1A1 (0.59) ALDH1A1L3MBTL1ENPEPCA2CA1

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
CN-103458920-B Show the glucagon analogs of GIP receptor active 印第安那大学科技研究公司 2016-07-06 CN disclosed