SCHEMBL18697361

SCHEMBL18697361

O=C(F)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
HSD17B10 Q99714 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL18697369 0.81 CA1 (0.44) CA1CA2CES2CES1TSHR
SCHEMBL516304 0.79 CA1 (0.36) CA1CA2CA9HSD17B10TSHR
SCHEMBL34317 0.79 CA1 (0.36) CA1CA2CA9HSD17B10TSHR
SCHEMBL176317 0.77 CA1 (0.35) CA1CA2CA9HSD17B10TSHR
SCHEMBL16814869 0.77 CA1 (0.35) CA1CA2CA9HSD17B10TSHR
SCHEMBL570928 0.77 PREP (0.39) CA1CA2CA9HSD17B10TSHR
SCHEMBL117240 0.74 CA1 (0.33) CA1CA2CA9HSD17B10CES2
SCHEMBL1350651 0.74 CA1 (0.39) CA1CA2CA9HSD17B10
SCHEMBL19576196 0.74 CA1 (0.33) CA1CA2CA9HSD17B10
SCHEMBL16932538 0.74 CA1 (0.33) CA1CA2CA9HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170194664-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY STORING DEVICE IN WHICH SAME IS USED MU IONIC SOLUTIONS CORPORATION (JP) 2017-07-06 US disclosed
US-20170194664-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY STORING DEVICE IN WHICH SAME IS USED MU IONIC SOLUTIONS CORPORATION (JP) 2017-07-06 US disclosed
EP-3151326-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY-STORING DEVICE IN WHICH SAME IS USED Ube Industries, Ltd. (JP) 2017-04-05 EP disclosed