SCHEMBL30287993

SCHEMBL30287993

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

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.60
▸ SLC7A5 Q01650 1/20 0.55
▸ ENPEP Q07075 5/20 0.55
▸ YARS1 P54577 2/20 0.53
▸ ACE P12821 1/20 0.52
▸ CPA1 P15085 1/20 0.52
▸ ACE2 Q9BYF1 1/20 0.52
▸ OPRD1 P41143 2/20 0.52
▸ OPRM1 P35372 1/20 0.52
▸ OPRK1 P41145 1/20 0.52

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
SCHEMBL30287990 1.00 MME (0.60) MMESLC7A5ENPEPYARS1ACE
SCHEMBL31025679 1.00 MME (0.60) MMESLC7A5ENPEPYARS1ACE
SCHEMBL30288011 0.96 MME (0.66) MMEACEOPRD1OPRM1OPRK1
SCHEMBL30288043 0.96 MME (0.66) MMEACEOPRD1OPRM1OPRK1
SCHEMBL30288033 0.96 MME (0.66) MMEACEOPRD1OPRM1OPRK1
SCHEMBL7149294 0.96 MME (0.60) MMESLC7A5ENPEPYARS1ACE
SCHEMBL7149290 0.96 MME (0.60) MMESLC7A5ENPEPYARS1ACE
SCHEMBL30326195 0.96 MME (0.60) MMESLC7A5ENPEPYARS1ACE
SCHEMBL30010358 0.95 MME (0.60) MMESLC7A5ENPEPACECPA1
SCHEMBL29645220 0.95 MME (0.60) MMESLC7A5ENPEPACECPA1

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
WO-2024163598-A2 PEPTIDES COMPRISING THIOESTER GROUPS, INCLUDING DEPSIPEPTIDE THIOESTERS, METHODS OF MAKING, AND USE THEREOF BRANDEIS UNIVERSITY (US) 2024-08-08 — — WO claimed
WO-2024163598-A2 PEPTIDES COMPRISING THIOESTER GROUPS, INCLUDING DEPSIPEPTIDE THIOESTERS, METHODS OF MAKING, AND USE THEREOF BRANDEIS UNIVERSITY (US) 2024-08-08 — — WO disclosed
CN-109475640-B Mixed carrier for nucleic acid carried article 库瑞瓦格欧洲公司 2023-03-10 — — CN disclosed
Send feedback