SCHEMBL8364103

SCHEMBL8364103

N[C@@H](CCc1ccccc1)C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 11/20 0.55
ACE P12821 7/20 0.53
DPP4 P27487 1/20 0.52
DPP8 Q6V1X1 1/20 0.52
DPP9 Q86TI2 1/20 0.52
DPP7 Q9UHL4 1/20 0.52
LMNA P02545 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
Hydrochloric Acid SCHEMBL38652340 0.89 FKBP1A (0.53) FKBP1AACEDPP4DPP8DPP9
SCHEMBL38652282 0.89 FKBP1A (0.53) FKBP1AACEDPP4DPP8DPP9
SCHEMBL8365666 0.89 DPP4 (0.61) FKBP1AACEDPP4DPP8DPP9
SCHEMBL7508784 0.89 DPP4 (0.61) FKBP1AACEDPP4DPP8DPP9
Hydrochloric Acid SCHEMBL38652210 0.88 FKBP1A (0.53) FKBP1AACEDPP4DPP8DPP9
SCHEMBL24645570 0.88 ACE (0.56) FKBP1AACELMNA
Hydrochloric Acid SCHEMBL10403931 0.88 DPP4 (0.60) FKBP1AACEDPP4DPP8DPP9
SCHEMBL29290357 0.88 FKBP1A (0.56) FKBP1AACEDPP4DPP8DPP9
SCHEMBL10888137 0.87 FKBP1A (0.54) FKBP1AACEDPP4DPP8DPP9
Hydrochloric Acid SCHEMBL7327619 0.87 FKBP1A (0.55) FKBP1AACEDPP4DPP8DPP9

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-2003057722-A2 CYCLIC TETRAPEPTIDE COMPOUND AND USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-17 WO disclosed