SCHEMBL9828033

SCHEMBL9828033

COC(=O)C(N)CCCCCCCCO

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.43
SPHK1 Q9NYA1 1/20 0.41
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
GNAI3 P08754 1/20 0.37
GNAO1 P09471 1/20 0.37
GNAI1 P63096 1/20 0.37
GSR P00390 1/20 0.36
ACHE P22303 6/20 0.36
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
NOS2 P35228 1/20 0.36
LTA4H P09960 1/20 0.35
DPP7 Q9UHL4 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL930524 0.98 ZDHHC7 (0.40) ZDHHC7SPHK1CA1CA2GNAI3
SCHEMBL930523 0.98 ZDHHC7 (0.40) ZDHHC7SPHK1CA1CA2GNAI3
Hydrochloric Acid SCHEMBL28366534 0.96 ZDHHC7 (0.39) ZDHHC7SPHK1CA1CA2GSR
Hydrochloric Acid SCHEMBL8883380 0.96 ZDHHC7 (0.39) ZDHHC7SPHK1CA1CA2GSR
SCHEMBL24075464 0.92 CA1 (0.39) ZDHHC7SPHK1CA1CA2GSR
SCHEMBL12534327 0.92 CA1 (0.39) ZDHHC7SPHK1CA1CA2GSR
SCHEMBL27405457 0.92 ZDHHC7 (0.48) ZDHHC7CA1CA2GNAI3GNAO1
SCHEMBL27405459 0.92 ZDHHC7 (0.48) ZDHHC7CA1CA2GNAI3GNAO1
SCHEMBL16330498 0.89 ZDHHC7 (0.45) ZDHHC7CA1CA2GNAI3GNAO1
SCHEMBL9383516 0.85 CA1 (0.43) ZDHHC7CA1CA2GSRLTA4H

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
EP-0413709-A4 FATTY AMINO ACIDS, AND HOMO- AND HETERO-OLIGOMERS AND CONJUGATES THEREOF GIBBONS WILLIAM ANTHONY (GB) 1991-12-27 EP disclosed
EP-0413709-A1 FATTY AMINO ACIDS, AND HOMO- AND HETERO-OLIGOMERS AND CONJUGATES THEREOF THE SCHOOL OF PHARMACY, UNIVERSITY OF LONDON (GB) 1991-02-27 EP disclosed
WO-1989010348-A1 FATTY AMINO ACIDS, AND HOMO- AND HETERO-OLIGOMERS AND CONJUGATES THEREOF SYNPHARM LTD (GB) 1989-11-02 WO disclosed