SCHEMBL7430616

SCHEMBL7430616

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 3/20 0.45
METAP1 P53582 3/20 0.45
MC4R P32245 1/20 0.45
MC3R P41968 1/20 0.45
DPEP1 P16444 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
REN P00797 1/20 0.40
LTA4H P09960 1/20 0.40
CPA1 P15085 2/20 0.40
MME P08473 1/20 0.39
ACE P12821 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
PPARG P37231 1/20 0.38
ANPEP P15144 2/20 0.38
ERAP2 Q6P179 2/20 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
SCHEMBL7430623 1.00 METAP2 (0.45) METAP2METAP1MC4RMC3RDPEP1
SCHEMBL8894607 0.89 MME (0.43) METAP2METAP1SLC1A3SLC1A2SLC1A1
SCHEMBL8894601 0.89 MME (0.43) METAP2METAP1SLC1A3SLC1A2SLC1A1
SCHEMBL7444348 0.88 DPEP1 (0.44) METAP2METAP1DPEP1SLC1A3SLC1A2
SCHEMBL7444337 0.88 DPEP1 (0.44) METAP2METAP1DPEP1SLC1A3SLC1A2
SCHEMBL7436178 0.85 EPHX1 (0.42) METAP2METAP1SLC1A3SLC1A2SLC1A1
SCHEMBL7433904 0.85 LDHA (0.45) METAP2METAP1POLBRENPPARG
SCHEMBL7436183 0.85 EPHX1 (0.42) METAP2METAP1SLC1A3SLC1A2SLC1A1
SCHEMBL7433911 0.85 LDHA (0.45) METAP2METAP1POLBRENPPARG
SCHEMBL7434192 0.82 SLC1A3 (0.50) SLC1A3SLC1A2SLC1A1CPA1MME

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-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
EP-0532466-A2 Derivatives of 5-amino-4-hydroxy-hexanoic acid and their therapeutical use CIBA-GEIGY AG (CH) 1993-03-17 EP disclosed