SCHEMBL8894601

SCHEMBL8894601

NC(CC1CCCCC1)C(O)CC(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.43
SLC7A5 Q01650 1/20 0.43
METAP2 P50579 4/20 0.43
METAP1 P53582 4/20 0.43
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
REN P00797 1/20 0.41
LTA4H P09960 1/20 0.40
ACE P12821 1/20 0.39
CPA1 P15085 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
PPARG P37231 1/20 0.39
ANPEP P15144 4/20 0.38
ERAP2 Q6P179 4/20 0.38
ERAP1 Q9NZ08 2/20 0.38
LAP3 P28838 1/20 0.38
ENPEP Q07075 1/20 0.38

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
SCHEMBL8894607 1.00 MME (0.43) MMESLC7A5METAP2METAP1SLC1A3
SCHEMBL7430623 0.89 METAP2 (0.45) MMEMETAP2METAP1SLC1A3SLC1A2
SCHEMBL7430616 0.89 METAP2 (0.45) MMEMETAP2METAP1SLC1A3SLC1A2
SCHEMBL7433904 0.86 LDHA (0.45) METAP2METAP1RENPPARGANPEP
SCHEMBL7436183 0.86 EPHX1 (0.42) MMEMETAP2METAP1SLC1A3SLC1A2
SCHEMBL7444337 0.86 DPEP1 (0.44) MMEMETAP2METAP1SLC1A3SLC1A2
SCHEMBL7433911 0.86 LDHA (0.45) METAP2METAP1RENPPARGANPEP
SCHEMBL7444348 0.86 DPEP1 (0.44) MMEMETAP2METAP1SLC1A3SLC1A2
SCHEMBL7436178 0.86 EPHX1 (0.42) MMEMETAP2METAP1SLC1A3SLC1A2
SCHEMBL7436920 0.82 SLC7A5 (0.56) MMESLC7A5SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5643878-A TREATMENT OF RETROVIRAL DISEASES LIKE AIDS CIBA-GEIGY CORPORATION (US) 1997-07-01 US disclosed
EP-0618222-A2 Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid CIBA-GEIGY AG (CH) 1994-10-05 EP disclosed