SCHEMBL7596003

SCHEMBL7596003

CCCCCCCCCCCC(N)OC(=O)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.48
NAAA Q02083 3/20 0.45
BCHE P06276 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
GRIK1 P39086 2/20 0.40
GRIK2 Q13002 2/20 0.40
METAP2 P50579 1/20 0.39
TSHR P16473 1/20 0.37
SLC1A2 P43004 1/20 0.37
SLC1A1 P43005 1/20 0.37
EPHX1 P07099 6/20 0.37
EPHX2 P34913 1/20 0.37

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
SCHEMBL31574353 0.83 CTSK (0.49) CTSKNAAABCHEALDH1A1KMT2A
SCHEMBL38663765 0.82 CTSK (0.48) CTSKNAAABCHEALDH1A1KMT2A
SCHEMBL31112868 0.82 CTSK (0.48) CTSKNAAABCHEALDH1A1KMT2A
SCHEMBL31112668 0.82 CTSK (0.48) CTSKNAAABCHEALDH1A1KMT2A
SCHEMBL9456683 0.78 GSR (0.40)
SCHEMBL7055726 0.78 GSR (0.40)
SCHEMBL29846113 0.78 CTSK (0.43) CTSKNAAAALDH1A1KMT2AEPHX2
SCHEMBL7438186 0.76 CTSK (0.48) CTSKNAAABCHEALDH1A1KMT2A
SCHEMBL17688564 0.76 NAAA (0.49) NAAABCHEALDH1A1KMT2AGRIK1
SCHEMBL28843002 0.76 NAAA (0.49) NAAABCHEALDH1A1KMT2AGRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019160694-A1 METHOD AND SYSTEM FOR TAGGING LEATHER OR HIDES TREATED WITH BIOCIDE AND IDENTIFYING SAME BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2019-08-22 WO claimed
US-20190249360-A1 Method And System For Tagging Leather Or Hides Treated With Biocide And Identifying Same BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2019-08-15 US claimed
EP-0969723-B1 Microbicidal combinations of Propiconazole with dodecylamine or a dodecylamine salt BUCKMAN LABOR INC (US) 2002-12-04 EP claimed
EP-0969723-A1 MICROBICIDAL COMBINATIONS OF PROPICONAZOLE WITH DODECYLAMINE OR A DODECYLAMINE SALT BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2000-01-12 EP claimed
US-5902820-A PROPICONAZOLE AND DODECYLAMINE OR A DODECYLAMINE SALT, PRESENT IN A SYNERGISTICALLY EFFECTIVE AMOUNT TO CONTROL THE GROWTH OF AT LEAST ONE MICROORGANISM BUCKMAN LABORATORIES INTERNATIONAL INC. (US) 1999-05-11 US claimed
WO-1998042190-A1 MICROBICIDAL COMBINATIONS OF PROPICONAZOLE WITH DODECYLAMINE OR A DODECYLAMINE SALT BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-10-01 WO claimed
EP-0969723-B1 Microbicidal combinations of Propiconazole with dodecylamine or a dodecylamine salt BUCKMAN LABOR INC (US) 2002-12-04 EP disclosed
EP-0969723-A1 MICROBICIDAL COMBINATIONS OF PROPICONAZOLE WITH DODECYLAMINE OR A DODECYLAMINE SALT BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2000-01-12 EP disclosed
US-5902820-A PROPICONAZOLE AND DODECYLAMINE OR A DODECYLAMINE SALT, PRESENT IN A SYNERGISTICALLY EFFECTIVE AMOUNT TO CONTROL THE GROWTH OF AT LEAST ONE MICROORGANISM BUCKMAN LABORATORIES INTERNATIONAL INC. (US) 1999-05-11 US disclosed
WO-1998042190-A1 MICROBICIDAL COMBINATIONS OF PROPICONAZOLE WITH DODECYLAMINE OR A DODECYLAMINE SALT BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-10-01 WO disclosed