SCHEMBL7385019

SCHEMBL7385019

O=C(O)CCNC(=O)[C@H](Cc1ccccc1)NC(CCc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.64
▸ ACE P12821 3/20 0.55
▸ NAALAD2 Q9Y3Q0 1/20 0.51
▸ MMEL1 Q495T6 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
Water SCHEMBL10949495 0.99 MME (0.62) MMEACENAALAD2MMEL1
SCHEMBL650610 0.91 ACE (0.59) MMEACENAALAD2MMEL1
SCHEMBL5603448 0.91 ACE (0.59) MMEACENAALAD2MMEL1
SCHEMBL391211 0.91 ACE (0.59) MMEACENAALAD2MMEL1
SCHEMBL10943595 0.87 HRH4 (0.50) MMEACE
SCHEMBL7380315 0.86 MMEL1 (0.64) MMEACEMMEL1
SCHEMBL7385743 0.86 MMEL1 (0.64) MMEACEMMEL1
SCHEMBL5870198 0.83 MME (0.88) MMEACENAALAD2
SCHEMBL8258027 0.83 MME (0.88) MMEACENAALAD2
SCHEMBL11296564 0.83 ATM (0.52) MMEACENAALAD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4906615-A Substituted dipeptides as inhibitors of enkephalinases SCHERING CORPORATION (US) 1990-03-06 — — US 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
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