SCHEMBL29468613

SCHEMBL29468613

CCCOP(=O)(O)CC(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 6/20 0.36
LPAR1 Q92633 4/20 0.36
LPAR2 Q9HBW0 3/20 0.36
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
PPARD Q03181 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LPAR5 Q9H1C0 1/20 0.32
FDPS P14324 1/20 0.31

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
SCHEMBL29468685 0.86 LPAR3 (0.55) LPAR3LPAR1LPAR2CYP3A4CYP2C9
SCHEMBL15194666 0.78 HTT (0.34)
SCHEMBL27982413 0.78 LMNA (0.36) LPAR3LPAR1LPAR2LMNAGAA
SCHEMBL777791 0.75
Ethyne SCHEMBL26619718 0.75 LMNA (0.34) LPAR3LPAR1LPAR2LMNAGAA
SCHEMBL29468598 0.75 LPAR3 (0.42) LPAR3LPAR2
SCHEMBL25400884 0.73 LPAR3 (0.37) LPAR3LPAR1LPAR2LMNAGAA
SCHEMBL28327368 0.73 LMNA (0.33) LMNAGAAMEN1KMT2ACYP3A4
SCHEMBL17626482 0.73 MEN1 (0.42) LPAR3LPAR1LPAR2PPARDMEN1
SCHEMBL17626598 0.73 LPAR3 (0.41) LPAR3LPAR1LPAR2PPARDMEN1

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-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-20220149436-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2022-05-12 US disclosed
US-11283107-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-22 US disclosed