SCHEMBL29319775

SCHEMBL29319775

Oc1cc(O)cc(-c2nc(F)c(F)c(F)c2F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ ABL1 P00519 2/20 0.33
▸ ABCB1 P08183 2/20 0.33
▸ BCR P11274 2/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ NQO1 P15559 1/20 0.33
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ PTGS1 P23219 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ SENP8 Q96LD8 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP6 Q9GZR1 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
SCHEMBL29319801 0.74 NQO1 (0.46) PDE4DABL1ABCB1BCRBACE1
SCHEMBL31540906 0.72 CYP1B1 (0.46) ABL1ABCB1BCRNPC1RAB9A
SCHEMBL445036 0.71 MEN1 (0.31) —
SCHEMBL6979135 0.70 XDH (0.50) TP53MAPK1SMN1; SMN2
SCHEMBL15624431 0.69 — —
SCHEMBL29319742 0.67 NQO1 (0.55) ABL1ABCB1BCRBACE1NQO1
SCHEMBL29319788 0.66 NQO1 (0.52) ABL1ABCB1BCRBACE1NQO1
SCHEMBL6976889 0.64 — —
SCHEMBL29319706 0.62 ABL1 (0.48) ABL1ABCB1BCRBACE1NQO1
SCHEMBL188694 0.61 MEN1 (0.41) —

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
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