SCHEMBL7436906

SCHEMBL7436906

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

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.50
METAP2 P50579 3/20 0.44
METAP1 P53582 2/20 0.44
SLC1A3 P43003 3/20 0.40
SLC1A2 P43004 3/20 0.40
SLC1A1 P43005 3/20 0.40
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
LTA4H P09960 1/20 0.39
CPN1 P15169 2/20 0.38
CPB2 Q96IY4 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
SCHEMBL7436910 1.00 REN (0.50) RENMETAP2METAP1SLC1A3SLC1A2
SCHEMBL9697153 0.88 REN (0.46) RENMETAP2METAP1SLC1A3SLC1A2
SCHEMBL10353656 0.83 GRIK1 (0.51) RENMETAP2METAP1SLC1A3SLC1A2
SCHEMBL4065186 0.82 REN (0.55) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL31109145 0.81 CPN1 (0.47) METAP2METAP1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL7360375 0.81 REN (0.54) RENMETAP2METAP1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL27673691 0.81 REN (0.54) RENMETAP2METAP1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL10676905 0.81 REN (0.54) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL8894601 0.80 MME (0.43) RENMETAP2METAP1SLC1A3SLC1A2
SCHEMBL8894607 0.80 MME (0.43) RENMETAP2METAP1SLC1A3SLC1A2

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