SCHEMBL28877776

SCHEMBL28877776

O=C(Nc1ccc(OC(F)(F)F)cc1)NC1CCN(C(=O)c2ccc(C(=O)NO)cc2)CC1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 20/20 0.78
EPHX1 P07099 2/20 0.70

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
SCHEMBL2716441 0.88 EPHX2 (1.00) EPHX2EPHX1
SCHEMBL29974553 0.85 EPHX2 (0.74) EPHX2
SCHEMBL28877736 0.85 EPHX2 (0.74) EPHX2
SCHEMBL4015938 0.85 EPHX2 (0.74) EPHX2EPHX1
SCHEMBL2719864 0.84 EPHX2 (1.00) EPHX2EPHX1
SCHEMBL17130358 0.84 EPHX2 (1.00) EPHX2EPHX1
SCHEMBL17420137 0.83 EPHX2 (0.83) EPHX2
SCHEMBL17420136 0.83 EPHX2 (0.83) EPHX2
SCHEMBL4304174 0.83 EPHX2 (0.81) EPHX2EPHX1
SCHEMBL17130379 0.83 EPHX2 (1.00) EPHX2EPHX1

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
CN-115141123-B Compound, preparation method thereof and application thereof in preparation of dual inhibitors of histone deacetylase and epoxide hydrolase 沈阳药科大学 2024-05-17 CN disclosed
CN-115141123-A Compound, preparation method thereof and application thereof in preparation of histone deacetylase and epoxide hydrolase dual inhibitor 沈阳药科大学 2022-10-04 CN disclosed