SCHEMBL5498101

SCHEMBL5498101

CC(C)(C)OC(=O)N(CC(=O)N1CCCC1B(O)O)C1CCNC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 18/20 0.51
▸ FAP Q12884 17/20 0.51
▸ DPP8 Q6V1X1 4/20 0.51
▸ DPP9 Q86TI2 4/20 0.51
▸ PREP P48147 8/20 0.47
▸ DPP7 Q9UHL4 8/20 0.43

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
SCHEMBL5498099 1.00 DPP4 (0.51) DPP4FAPDPP8DPP9PREP
SCHEMBL2956816 0.80 FAP (0.59) DPP4FAPDPP8DPP9PREP
SCHEMBL2959334 0.80 FAP (0.59) DPP4FAPDPP8DPP9PREP
SCHEMBL2956815 0.78 FAP (0.54) DPP4FAPDPP8DPP9PREP
SCHEMBL2555618 0.73 SLC6A4 (0.47) —
SCHEMBL20905448 0.73 SLC6A4 (0.47) —
SCHEMBL4853479 0.73 SLC6A4 (0.47) —
SCHEMBL25105353 0.71 SLC6A2 (0.48) —
SCHEMBL25105977 0.71 SLC6A2 (0.48) —
SCHEMBL25260214 0.71 SLC6A2 (0.48) —

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
EP-1689757-A4 HETEROCYCLIC BORONIC ACID COMPOUNDS PHENOMIX CORP (US) 2007-01-10 — — EP disclosed
EP-1689757-A1 HETEROCYCLIC BORONIC ACID COMPOUNDS Phenomix Corporation (US) 2006-08-16 — — EP disclosed
WO-2005047297-A1 HETEROCYCLIC BORONIC ACID COMPOUNDS PHENOMIX CORPORATION (US) 2005-05-26 — — WO disclosed
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