SCHEMBL10943545

SCHEMBL10943545

CCO[C@H]1[C@@H](NC(=O)C(F)(F)F)C[C@@H](OC)O[C@H]1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 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
SCHEMBL10943549 1.00 KDM4E (0.31) KDM4E
SCHEMBL11420286 0.88 — —
SCHEMBL11420289 0.88 — —
SCHEMBL10944398 0.86 — —
SCHEMBL10944405 0.86 — —
SCHEMBL10947733 0.85 — —
SCHEMBL10947740 0.85 — —
SCHEMBL10945491 0.84 CYP2C9 (0.34) —
SCHEMBL10945498 0.84 CYP2C9 (0.34) —
SCHEMBL10942967 0.82 TACR1 (0.37) —

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
US-4526960-A Pharmaceuticals HOFFMANN-LA ROCHE INC. (US) 1985-07-02 — — US disclosed
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