SCHEMBL8114261

SCHEMBL8114261

CCCCCCCCCCCCC(C)C(=O)C(C)=O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.57
ACE2 Q9BYF1 1/20 0.52
GPR84 Q9NQS5 7/20 0.48
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 1/20 0.47
FDPS P14324 3/20 0.47
MAPT P10636 1/20 0.45
LCK P06239 1/20 0.45
PPARD Q03181 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
CA2 P00918 1/20 0.44

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
SCHEMBL27549713 0.98 CA1 (0.59) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL7944792 0.91 CA1 (0.50) CA1ACE2GPR84FDPSCA2
SCHEMBL18759148 0.83 CA1 (0.57) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL2573740 0.82 CA1 (0.61) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL574092 0.82 CA1 (0.61) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL13819793 0.82 CA1 (0.61) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL13819794 0.82 CA1 (0.61) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL13819798 0.82 CA1 (0.61) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL11386622 0.82 CA1 (0.61) CA1ACE2GPR84FFAR1FFAR4
SCHEMBL13538692 0.82 CA1 (0.61) CA1ACE2GPR84FFAR1FFAR4

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
JP-2000288399-A RUTHENIUM-OPTICALLY ACTIVE PHOSPHINE COMPLEX MIXTURE, ITS PRODUCTION, AND ASYMMETRIC HYDROGENATION CATALYST USING IT TAKASAGO INTERNATL CORP 2000-10-17 JP disclosed