SCHEMBL29319782

SCHEMBL29319782

Oc1cc(O)cc(Oc2c(F)c(F)cc(F)c2F)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 8/20 0.52
ACHE P22303 7/20 0.39
BCHE P06276 5/20 0.39
HSP90AA1 P07900 2/20 0.38
PTPN1 P18031 1/20 0.36
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
PTGS1 P23219 1/20 0.32
LCK P06239 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
SCHEMBL29319771 0.79 BACE1 (0.44) BACE1ACHEBCHEHSP90AA1PTPN1
SCHEMBL31031424 0.77 BACE1 (0.79) BACE1ACHEBCHEHSP90AA1PTPN1
SCHEMBL29320235 0.76 TSHR (0.43) BACE1ACHEBCHEHSP90AA1PTPN1
SCHEMBL29464019 0.75 CA1 (0.36) HSP90AA1MAPTPOLBCA12CA1
SCHEMBL30862409 0.74 ALDH1A1 (0.48) HSP90AA1PTPN1MAPTPOLB
SCHEMBL30589988 0.73 BACE1 (0.73) BACE1ACHEBCHEHSP90AA1PTPN1
SCHEMBL5032127 0.72 HSP90AA1 (0.58) BACE1ACHEBCHEHSP90AA1PTPN1
SCHEMBL30450089 0.70 BACE1 (0.63) BACE1ACHEBCHEPTPN1MAPT
SCHEMBL30726111 0.70 BACE1 (0.63) BACE1ACHEBCHEPTPN1MAPT
SCHEMBL24506246 0.68 MAPT (0.58) HSP90AA1MAPTPOLBCA12CA1

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-20240239931-A1 FLUORINATED RESORCINOL AND HYDROQUINONE ANALOGS AS CURING AGENTS FOR FLUOROELASTOMERS CHEMOURS COMPANY FC, LLC, THE 2024-07-18 US disclosed
US-20240239931-A1 FLUORINATED RESORCINOL AND HYDROQUINONE ANALOGS AS CURING AGENTS FOR FLUOROELASTOMERS CHEMOURS COMPANY FC, LLC, THE 2024-07-18 US disclosed