SCHEMBL8580673

SCHEMBL8580673

CCCCCCCCCCCCCCCCCCCCCCOC(=O)NCCCCCCCCCCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 13/20 0.50
EPHX2 P34913 5/20 0.49
DGKA P23743 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
SCHEMBL8579534 1.00 ACHE (0.50) ACHEEPHX2DGKA
SCHEMBL8574234 1.00 ACHE (0.50) ACHEEPHX2DGKA
SCHEMBL8575651 1.00 ACHE (0.50) ACHEEPHX2DGKA
SCHEMBL8575199 1.00 ACHE (0.50) ACHEEPHX2DGKA
SCHEMBL8576974 1.00 ACHE (0.50) ACHEEPHX2DGKA
SCHEMBL8575788 1.00 ACHE (0.50) ACHEEPHX2DGKA
SCHEMBL8578551 1.00 ACHE (0.50) ACHEEPHX2DGKA
SCHEMBL8576666 0.87 ACHE (0.46) ACHEEPHX2
SCHEMBL8579711 0.87 ACHE (0.46) ACHEEPHX2
SCHEMBL8752071 0.87 DGKA (0.57) DGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5753240-A PERFLUORINATED ALKYL-N-ALKYLOXYCARBONYL-ALKYLCARBAMATES USED AS THICKENING AGENTS IN DRUGS AND COSMETICS L'OREAL (FR) 1998-05-19 US claimed