SCHEMBL29936286

SCHEMBL29936286

O=C(OCC(F)(F)F)C(F)C(=O)OCC(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.65
FABP7 O15540 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL28373897 0.88 HTT (0.58) HTTFABP7ALDH1A1
SCHEMBL27186870 0.86 HTT (0.56) HTTFABP7ALDH1A1MEN1TSHR
SCHEMBL19857432 0.84 HTT (0.65) HTTFABP7CA1CA2CA9
SCHEMBL19857483 0.80 HTT (0.60) HTTFABP7CA1CA2CA9
SCHEMBL19857437 0.80 HTT (0.60) HTTFABP7CA1CA2CA9
SCHEMBL7417210 0.79 HTT (1.00) HTTFABP7CA1CA2CA9
SCHEMBL7417213 0.79 HTT (1.00) HTTFABP7CA1CA2CA9
SCHEMBL19857463 0.78 HTT (0.58) HTTFABP7
SCHEMBL28371570 0.77 HTT (0.62) HTTFABP7CA1CA2CA9
SCHEMBL15522581 0.77 HTT (0.62) HTTFABP7CA1CA2CA9

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-12095038-B2 Secondary battery MURATA MANUFACTURING CO., LTD. (JP) 2024-09-17 US disclosed
US-20220302500-A1 SECONDARY BATTERY MURATA MANUFACTURING CO., LTD. (JP) 2022-09-22 US disclosed