SCHEMBL28569437

SCHEMBL28569437

CC1(C)OB(c2c(O)cc(F)cc2F)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPL P06858 3/20 0.40
LIPG Q9Y5X9 3/20 0.40
CA9 Q16790 2/20 0.32
CA3 P07451 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
ROCK1 Q13464 1/20 0.30
P2RX7 Q99572 1/20 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
SCHEMBL25418201 0.87 LPL (0.46) LPLLIPGROCK1P2RX7
SCHEMBL31088896 0.84 LPL (0.39) LPLLIPG
SCHEMBL22655066 0.83 LPL (0.34) LPLLIPGCA9CA1CA2
SCHEMBL22654916 0.83 LPL (0.38) LPLLIPGCA9CA1CA2
SCHEMBL29508571 0.83 LPL (0.34) LPLLIPGCA9CA1CA2
SCHEMBL31089069 0.80 LPL (0.36) LPLLIPGROCK1
SCHEMBL31405026 0.80 LPL (0.33) LPLLIPG
SCHEMBL30413135 0.80 LPL (0.36) LPLLIPG
SCHEMBL29255623 0.80 LPL (0.36) LPLLIPG
SCHEMBL25551972 0.80 LPL (0.41) LPLLIPGP2RX7

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-110483748-B Bipyridyl bisphenol-aluminum catalyst for preparing unsaturated polyester and preparation method thereof 天津大学 2021-06-08 CN disclosed