SCHEMBL8366753

SCHEMBL8366753

N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1C(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 7/20 0.58
ACE P12821 4/20 0.55
SLC6A2 P23975 1/20 0.51
OPRM1 P35372 2/20 0.50
OPRD1 P41143 1/20 0.50
OPRK1 P41145 1/20 0.50

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
SCHEMBL8364232 0.98 ACE (0.57) FKBP1AACESLC6A2OPRM1OPRD1
SCHEMBL8365677 0.98 ACE (0.57) FKBP1AACESLC6A2OPRM1OPRD1
SCHEMBL8365056 0.91 ACE (0.56) FKBP1AACESLC6A2
SCHEMBL8366880 0.91 ACE (0.56) FKBP1AACESLC6A2OPRM1OPRD1
SCHEMBL8366851 0.90 ACE (0.53) FKBP1AACEOPRM1OPRD1OPRK1
SCHEMBL8365060 0.90 ACE (0.58) FKBP1AACESLC6A2OPRM1
SCHEMBL6439093 0.87 ACE (0.62) FKBP1AACE
SCHEMBL28255251 0.86 ACE (0.63) ACE
SCHEMBL28255253 0.86 ACE (0.63) ACE
SCHEMBL8365666 0.85 DPP4 (0.61) FKBP1AACE

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