SCHEMBL7590585

SCHEMBL7590585

OC(O)CNCCNCC(O)O

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PKM P14618 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
SCHEMBL22125292 0.84
SCHEMBL5567532 0.83
SCHEMBL8214608 0.83 CA12 (0.58) PKM
SCHEMBL11424430 0.81
Hydrochloric Acid SCHEMBL28419848 0.81 PKM (0.32) PKM
SCHEMBL9243592 0.81
SCHEMBL539203 0.81
SCHEMBL12148603 0.79 CA1 (0.34)
SCHEMBL10063665 0.79
SCHEMBL606749 0.78 CA12 (0.47) PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1171561-A1 DETERGENT COMPOSITION COMPRISING ANTI-HAZING AGENT THE PROCTER & GAMBLE COMPANY (US) 2002-01-16 EP claimed
WO-2000063333-A1 DETERGENT COMPOSITION COMPRISING ANTI-HAZING AGENT THE PROCTER & GAMBLE COMPANY (US) 2000-10-26 WO claimed
EP-1171561-A1 DETERGENT COMPOSITION COMPRISING ANTI-HAZING AGENT THE PROCTER & GAMBLE COMPANY (US) 2002-01-16 EP disclosed
WO-2000063333-A1 DETERGENT COMPOSITION COMPRISING ANTI-HAZING AGENT THE PROCTER & GAMBLE COMPANY (US) 2000-10-26 WO disclosed