SCHEMBL14301366

SCHEMBL14301366

CCCCCC(C)CCCCC(C)(O)CCCC(C)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.42
FDPS P14324 10/20 0.37
GGPS1 O95749 6/20 0.37
SPHK1 Q9NYA1 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
CDC25B P30305 1/20 0.37
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
KMT2A Q03164 1/20 0.36
OPRM1 P35372 1/20 0.34
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCH P24723 1/20 0.34
PRKCI P41743 1/20 0.34
PRKCE Q02156 1/20 0.34
PRKCQ Q04759 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
SCHEMBL13384358 0.92 FDPS (0.42) FDPSGGPS1SPHK1
SCHEMBL5584047 0.86 ACACB (0.33) FDPSGGPS1SPHK1PTPN2PTPN1
SCHEMBL16074752 0.85 FDPS (0.42) FDPSGGPS1SPHK1
SCHEMBL9343954 0.84 ACE2 (0.54) ACE2SPHK1CYP3A4OPRM1PRKD3
SCHEMBL13384040 0.82 ACE2 (0.37) ACE2FDPSGGPS1PTPN2PTPN1
SCHEMBL5583803 0.82 ACE2 (0.57) ACE2SPHK1CYP3A4OPRM1PRKD3
SCHEMBL5583776 0.82 ACE2 (0.57) ACE2SPHK1CYP3A4OPRM1PRKD3
SCHEMBL5583528 0.82 ACE2 (0.57) ACE2SPHK1CYP3A4OPRM1PRKD3
SCHEMBL5583764 0.82 ACE2 (0.57) ACE2SPHK1CYP3A4OPRM1PRKD3
SCHEMBL5583600 0.82 ACE2 (0.57) ACE2SPHK1CYP3A4OPRM1PRKD3

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
WO-2008019352-A1 BIOMIMETIC COMPOUNDS AND SYNTHETIC METHODS THEREFOR NERITES CORPORATION (US) 2008-02-14 WO disclosed