SCHEMBL18211786

SCHEMBL18211786

COC(=O)C(=O)OC(C(F)(F)F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 6/20 0.38
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.32
TET2 Q6N021 1/20 0.32
GPR35 Q9HC97 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
SCHEMBL15824292 0.87 CA1 (0.36) ABHD6CA1CA2CA9
SCHEMBL8761620 0.81 ALDH1A1 (0.58) ABHD6ALDH1A1MAPT
SCHEMBL17958378 0.80 ABHD6 (0.40) ABHD6CA1CA2CA9ALDH1A1
SCHEMBL18211790 0.79 ABHD6 (0.33) ABHD6
SCHEMBL21208171 0.78 ABHD6 (0.35) ABHD6CA1CA2CA9
SCHEMBL18211785 0.76 ALDH1A1 (0.37) ALDH1A1MAPTGPR35
SCHEMBL6278994 0.75 ABHD6 (0.33) ABHD6CA1CA2CA9
SCHEMBL47311 0.74 ALDH1A1 (0.42) ABHD6ALDH1A1
SCHEMBL7937646 0.74 ALDH1A1 (0.34) ABHD6ALDH1A1MAPTTET2
SCHEMBL18213775 0.74 ABHD6 (0.31) ABHD6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160329599-A1 Lithium Secondary Battery Electrolyte and Lithium Secondary Battery Comprising Same SK INNOVATION CO., LTD. (KR) 2016-11-10 US disclosed
US-20160329599-A1 Lithium Secondary Battery Electrolyte and Lithium Secondary Battery Comprising Same SK INNOVATION CO., LTD. (KR) 2016-11-10 US disclosed