SCHEMBL28124103

SCHEMBL28124103

O=C(OC(=O)C(F)(F)F)C1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.30

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
SCHEMBL5233663 0.89 EPHX2 (0.33) EPHX2
SCHEMBL6256278 0.88 HTT (0.31)
SCHEMBL27631315 0.82 SMN1; SMN2 (0.41)
SCHEMBL775473 0.82 CES2 (0.37)
SCHEMBL17423456 0.81 PIK3CD (0.33)
SCHEMBL20599512 0.80 CES2 (0.41)
SCHEMBL5796979 0.77 GABRP (0.43) EPHX2
SCHEMBL28571910 0.76 EPHX2 (0.33) EPHX2
SCHEMBL5909712 0.73 HRH3 (0.40) EPHX2
SCHEMBL18988346 0.73 EPHX2 (0.32) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106660954-A Substituted azaspiro(4.5)decane derivatives 格吕伦塔尔有限公司 2017-05-10 CN disclosed