SCHEMBL7374304

SCHEMBL7374304

CC(C)(C)C(=O)OCOC(=O)C(Cc1ccc(-c2ccccc2)cc1)N[C@@H](Cc1ccccc1)C(=O)NCCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMEL1 Q495T6 1/20 0.51
ADCY6 O43306 1/20 0.46
ADCY3 O60266 1/20 0.46
ADCY9 O60503 1/20 0.46
ADCY5 O95622 1/20 0.46
ADCY8 P40145 1/20 0.46
GCGR P47871 1/20 0.46
ADCY7 P51828 1/20 0.46
ADCY2 Q08462 1/20 0.46
ADCY1 Q08828 1/20 0.46
ADCY4 Q8NFM4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
MME P08473 1/20 0.43
ACE P12821 1/20 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
SCHEMBL7373720 1.00 MMEL1 (0.51) MMEL1ADCY6ADCY3ADCY9ADCY5
SCHEMBL7383300 0.99 MMEL1 (0.52) MMEL1ADCY6ADCY3ADCY9ADCY5
SCHEMBL7383447 0.96 ACE (0.46) MMEL1MMEACE
SCHEMBL10713161 0.94 L3MBTL1 (0.43) MMEL1ADCY6ADCY3ADCY9ADCY5
SCHEMBL10646158 0.91 KMT2A (0.45) MMEL1MMEACE
SCHEMBL7377271 0.88 POLB (0.40) L3MBTL1MMEACE
SCHEMBL11072416 0.85 MME (0.42) MMEL1MMEACE
SCHEMBL7377272 0.85 MME (0.56) MMEACE
SCHEMBL11074282 0.84 CTSS (0.42) MMEL1MMEACE
SCHEMBL7375938 0.83 MME (0.42) MMEL1MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0103077-B1 SUBSTITUTED DIPEPTIDES, METHODS FOR THEIR PRODUCTION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, METHOD FOR MAKING SUCH PHARMACEUTICAL COMPOSITIONS SCHERING CORPORATION (US) 1988-05-18 EP claimed
EP-0103077-A2 Substituted dipeptides, methods for their production, pharmaceutical compositions containing them, method for making such pharmaceutical compositions SCHERING CORPORATION (US) 1984-03-21 EP claimed
US-4906615-A Substituted dipeptides as inhibitors of enkephalinases SCHERING CORPORATION (US) 1990-03-06 US disclosed
EP-0103077-B1 SUBSTITUTED DIPEPTIDES, METHODS FOR THEIR PRODUCTION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, METHOD FOR MAKING SUCH PHARMACEUTICAL COMPOSITIONS SCHERING CORPORATION (US) 1988-05-18 EP disclosed
US-4721726-A ANALGESICS SCHERING CORPORATION (US) 1988-01-26 US disclosed
US-4610816-A ANALGESICS SCHERING CORPORATION (US) 1986-09-09 US disclosed