SCHEMBL3792494

SCHEMBL3792494

O=C1CCC(C(O)(C(F)(F)F)C(F)(F)F)O1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
MLYCD O95822 4/20 0.31
CYP1A2 P05177 2/20 0.30

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
SCHEMBL9559189 0.83 CA1 (0.44) CA1CA9CYP1A2
SCHEMBL18386614 0.79 CA1 (0.41) CA1CA9CYP1A2
SCHEMBL12182879 0.79 CA1 (0.44) CA1CA9CYP1A2
SCHEMBL9927430 0.75 CA1 (0.46) CA1CA9CYP1A2
SCHEMBL9607559 0.70 CA1 (0.50) CA1CA9CYP1A2
SCHEMBL9607558 0.70 CA1 (0.50) CA1CA9CYP1A2
SCHEMBL2664154 0.70 CA1 (0.50) CA1CA9CYP1A2
SCHEMBL5258367 0.67 CA1 (0.38) CA1CA9CYP1A2
SCHEMBL6357100 0.67 CA1 (0.41) CA1CA9
SCHEMBL25858060 0.66 CA1 (0.34) CA1CA9

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-7776779-B2 Mesoporous carbon, manufacturing method thereof, and fuel cell using the mesoporous carbon SAMSUNG SDI CO., LTD. (KR) 2010-08-17 US disclosed