SCHEMBL8903262

SCHEMBL8903262

CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.61
MME P08473 5/20 0.61
CPA1 P15085 2/20 0.61
ACE2 Q9BYF1 1/20 0.61
FOLH1 Q04609 1/20 0.59
GNPAT O15228 1/20 0.59
NAALAD2 Q9Y3Q0 1/20 0.56
LMNA P02545 1/20 0.56
GRIA1 P42261 1/20 0.55
CPA2 P48052 1/20 0.55
CPA4 Q9UI42 1/20 0.55

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
SCHEMBL5997104 0.96 MME (0.66) ACEMMECPA1ACE2GNPAT
SCHEMBL15692299 0.96 MME (0.66) ACEMMECPA1ACE2GNPAT
SCHEMBL15692300 0.96 MME (0.66) ACEMMECPA1ACE2GNPAT
Acetyl Tyrosine SCHEMBL8977601 0.94 FOLH1 (0.66) ACEMMECPA1ACE2FOLH1
Acetyl Tyrosine SCHEMBL1204300 0.94 FOLH1 (0.66) ACEMMECPA1ACE2FOLH1
Acetyl Tyrosine SCHEMBL321220 0.94 FOLH1 (0.66) ACEMMECPA1ACE2FOLH1
Acetyl Tyrosine SCHEMBL313539 0.94 FOLH1 (0.66) ACEMMECPA1ACE2FOLH1
Acetyl Tyrosine SCHEMBL8977600 0.94 FOLH1 (0.66) ACEMMECPA1ACE2FOLH1
SCHEMBL5995731 0.93 MME (0.63) ACEMMECPA1ACE2FOLH1
SCHEMBL30073136 0.93 GNPAT (0.55) ACEMMECPA1ACE2FOLH1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3777876-B1 N-ACYLDIPEPTIDE DERIVATIVES AND THEIR USES NEOSTRATA COMPANY INC (US) 2023-08-09 EP claimed
EP-3777876-B1 N-ACYLDIPEPTIDE DERIVATIVES AND THEIR USES NEOSTRATA COMPANY INC (US) 2023-08-09 EP disclosed
US-5698522-A INHIBIT RELEASE OF LUTEINIZING HORMONE RELEASING HORMONE ABBOTT LABORATORIES (US) 1997-12-16 US disclosed
US-5491217-A DECAPEPTIDES TAP HOLDING INC. (US) 1996-02-13 US disclosed