SCHEMBL9701050

SCHEMBL9701050

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

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CA2 P00918 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
Boric Acid SCHEMBL28203899 0.91
SCHEMBL52 0.86 CA2 (0.35) CA2
SCHEMBL27623481 0.86 CA2 (0.35) CA2
SCHEMBL27487352 0.85
SCHEMBL27530442 0.83 ALDH1A1 (0.32)
SCHEMBL3945654 0.83 CA2 (0.33) CA2
Hydrogen Peroxide SCHEMBL2051538 0.83 CA2 (0.33) CA2
Water SCHEMBL6513542 0.83 CA2 (0.33) CA2
SCHEMBL20135729 0.83 CA2 (0.33) CA2
Hydrochloric Acid SCHEMBL8958370 0.83 CA2 (0.33) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107710462-A Electrochemical hydrogen storage electrode and battery 巴斯夫公司 2018-02-16 CN claimed
CN-107710462-A Electrochemical hydrogen storage electrode and battery 巴斯夫公司 2018-02-16 CN disclosed
CN-107004912-A Electrolyte and metal hydride battery 巴斯夫公司 2017-08-01 CN disclosed
EP-0498941-A2 Peptide skeletal muscle relaxants BOC Health Care, Inc. (US) 1992-08-19 EP disclosed