SCHEMBL15840389

SCHEMBL15840389

C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.42
DPP8 Q6V1X1 2/20 0.38
DPP7 Q9UHL4 1/20 0.38
PAX8 Q06710 1/20 0.37
OPRD1 P41143 9/20 0.35
OPRM1 P35372 4/20 0.35
OPRK1 P41145 1/20 0.35
TERT O14746 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
PTGS2 P35354 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CTRB1 P17538 2/20 0.34
DPP9 Q86TI2 1/20 0.34
METAP1 P53582 1/20 0.33
SLC15A1 P46059 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
SCHEMBL30765078 0.92 DPP4 (0.41) DPP4DPP8DPP7PAX8OPRD1
SCHEMBL9214801 0.86 TERT (0.42) DPP4DPP8DPP7PAX8TERT
SCHEMBL15623649 0.86 TERT (0.42) DPP4DPP8DPP7PAX8TERT
SCHEMBL2544527 0.85 ALDH1A1 (0.52) DPP4DPP8DPP7PAX8OPRD1
SCHEMBL11253834 0.85 ALDH1A1 (0.52) DPP4DPP8DPP7PAX8OPRD1
SCHEMBL29355244 0.83 ALDH1A1 (0.50) DPP4DPP8DPP7PAX8OPRD1
SCHEMBL29589671 0.83 ALDH1A1 (0.50) DPP4DPP8DPP7PAX8OPRD1
SCHEMBL26255671 0.82 DPP4 (0.44) DPP4DPP8DPP7PAX8OPRD1
SCHEMBL17571065 0.82 ALDH1A1 (0.35) OPRD1OPRM1OPRK1ALDH1A1LMNA
SCHEMBL11788108 0.82 SLC7A5 (0.41) DPP4DPP8OPRD1OPRM1OPRK1

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-2014095773-A1 PEPTIDES AS OXYTOCIN AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2014-06-26 WO disclosed