SCHEMBL7166074

SCHEMBL7166074

NCCCCCC(C(=O)O)C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 4/20 0.49
▸ ITGA2B P08514 4/20 0.49
▸ LTA4H P09960 1/20 0.47
▸ CPB2 Q96IY4 3/20 0.47
▸ EPOR P19235 2/20 0.46
▸ ECE1 P42892 1/20 0.45
▸ CPB1 P15086 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPK1 P28482 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ SIRT2 Q8IXJ6 1/20 0.43
▸ SIRT1 Q96EB6 1/20 0.43
▸ SIRT3 Q9NTG7 1/20 0.43

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
SCHEMBL4384791 1.00 ITGB3 (0.49) ITGB3ITGA2BLTA4HCPB2EPOR
SCHEMBL5241716 0.98 LTA4H (0.48) ITGB3ITGA2BLTA4HCPB2EPOR
SCHEMBL11588837 0.94 ALDH1A1 (0.47) ITGB3ITGA2BLTA4HEPORALDH1A1
SCHEMBL8643591 0.87 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL5242448 0.87 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL34463650 0.85 LTA4H (0.47) ITGB3ITGA2BLTA4HCPB2EPOR
SCHEMBL27635585 0.85 SLC1A1 (0.50) LTA4HALDH1A1KMT2ATDP1
SCHEMBL8618743 0.85 LTA4H (0.56) ITGB3ITGA2BLTA4HEPORALDH1A1
SCHEMBL27635584 0.85 SLC1A1 (0.50) LTA4HALDH1A1KMT2ATDP1
Hydrochloric Acid SCHEMBL6671170 0.84 LTA4H (0.55) ITGB3ITGA2BLTA4HEPOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0789578-B1 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON INC (US) 2003-06-04 — — EP disclosed
EP-0789578-A4 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON INC (US) 2000-09-20 — — EP disclosed
US-5990083-A Multicatalytic protease inhibitors CEPHALON, INC. (US) 1999-11-23 — — US disclosed
US-5830870-A PREVENT LOSS OF MUSCLE MASS CEPHALON, INC. (US) 1998-11-03 — — US disclosed
CN-1164192-A Inhibitors of heterogeneously catalyzed proteases CEPHALON INC (US) 1997-11-05 — — CN disclosed
EP-0789578-A1 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON, INC. (US) 1997-08-20 — — EP disclosed
US-5614649-A TREATMENT OF MUSCULAR DISORDERS, SUBSTITUTED GUANIDINES CEPHALON, INC. (US) 1997-03-25 — — US disclosed
US-5550262-A TREATMENT OF MUSCLES WASTING DISEASES CEPHALON, INC. (US) 1996-08-27 — — US disclosed
WO-1996014857-A1 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON, INC. (US) 1996-05-23 — — WO disclosed
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