SCHEMBL28895707

SCHEMBL28895707

CCCCC(C)CC(C)(O)O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.37
MAPK1 P28482 1/20 0.37
ACE2 Q9BYF1 1/20 0.36
CA1 P00915 4/20 0.35
FDPS P14324 2/20 0.35
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
DNM1 Q05193 1/20 0.33
OPRM1 P35372 1/20 0.32

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
SCHEMBL26103400 0.86 MEN1 (0.38) CA2MAPK1ACE2CA1FDPS
SCHEMBL28626224 0.85 TSHR (0.48) TSHR
SCHEMBL27516913 0.83 ACE2 (0.38) CA2MAPK1ACE2CA1FDPS
SCHEMBL18681323 0.80 DNM1 (0.36) CA2MAPK1ACE2CA1FDPS
SCHEMBL15697273 0.79 CES1 (0.33) CA2MAPK1ACE2CA1FDPS
SCHEMBL1784525 0.78 CTSK (0.36) CA2MAPK1ACE2CA1FDPS
Hexane SCHEMBL27310611 0.78 DNM1 (0.40) CA2MAPK1ACE2CA1FDPS
SCHEMBL8380932 0.77 ALDH1A1 (0.37) CA2MAPK1ACE2CA1FDPS
SCHEMBL27630081 0.77 ACE2 (0.42) CA2MAPK1ACE2CA1FDPS
SCHEMBL26106306 0.77 ACE2 (0.47) CA2ACE2CA1FDPSMAPT

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
CN-115216356-A Base oil for fluid dynamic bearing lubricant, fluid dynamic bearing, motor, and fan motor 日本电产株式会社 2022-10-21 CN disclosed