SCHEMBL575254

SCHEMBL575254

O=P(O)(CC(F)(F)F)OC(C1CCCCC1)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.32
ANPEP P15144 2/20 0.31
ERAP2 Q6P179 2/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
MMP2 P08253 2/20 0.31
CA9 Q16790 2/20 0.31
EPHX1 P07099 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
SCHEMBL575576 0.84 MMP2 (0.34) METAP1ANPEPERAP2CA12CA1
SCHEMBL575392 0.82 CA12 (0.33) METAP1CA12CA1CA2MMP2
SCHEMBL575250 0.80 TSHR (0.35) CA12CA1CA2MMP2CA9
SCHEMBL2488494 0.79 MMP2 (0.37) METAP1ANPEPERAP2CA12CA1
SCHEMBL4139030 0.78 MMP2 (0.33) METAP1CA12CA1CA2MMP2
SCHEMBL4126663 0.75 CA12 (0.32) CA12CA1CA2MMP2CA9
SCHEMBL4131679 0.74 SHBG (0.34)
SCHEMBL4139035 0.73
SCHEMBL16924850 0.72 SHBG (0.32)
SCHEMBL4132349 0.70 CYP1A2 (0.33)

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-11283107-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-22 US disclosed
EP-2418723-A1 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same Mitsubishi Chemical Corporation (JP) 2012-02-15 EP disclosed
EP-2378602-A2 Nonaqueous electrolyte for recherable battery, and recharchable battery with nonaqueous electrolyte Mitsubishi Chemical Corporation (JP) 2011-10-19 EP disclosed