SCHEMBL28829403

SCHEMBL28829403

[O-][S+](c1ccccc1F)C(F)F

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.37
GAA P10253 1/20 0.32
NFE2L2 Q16236 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
SCHEMBL775875 0.75 ACHE (0.43) ACHEGAANFE2L2
SCHEMBL514390 0.73 ACHE (0.42) ACHEGAANFE2L2
SCHEMBL31005130 0.72 ACHE (0.50) ACHEGAANFE2L2
SCHEMBL3207396 0.72 ACHE (0.50) ACHEGAANFE2L2
SCHEMBL2460604 0.71 ACHE (0.40) ACHEGAANFE2L2
SCHEMBL18195202 0.71 ACHE (0.40) ACHEGAANFE2L2
SCHEMBL31339586 0.70 ALDH1A1 (0.31)
SCHEMBL29143241 0.69 TSHR (0.38) GAA
SCHEMBL776881 0.69
SCHEMBL777872 0.68 ACHE (0.37) ACHENFE2L2

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
CN-110372550-A Aryl ether and application thereof 佩洛通治疗公司 2019-10-25 CN disclosed
CN-105530923-B Aryl ethers and their use 佩洛通治疗公司 2019-07-23 CN disclosed
CN-105530923-A Aryl ethers and their use PELOTON THERAPEUTICS INC 2016-04-27 CN disclosed