SCHEMBL13003396

SCHEMBL13003396

CN1CCOC(F)(F)C1=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL17345852 0.76 LMNA (0.37) —
SCHEMBL29348245 0.75 OPRM1 (0.30) —
SCHEMBL22511149 0.69 SIGMAR1 (0.36) —
SCHEMBL12228048 0.69 CRBN (0.35) —
SCHEMBL22511151 0.66 ALDH1A1 (0.39) —
SCHEMBL24851905 0.65 — —
SCHEMBL22450108 0.65 KDM4E (0.32) —
SCHEMBL13003405 0.65 DDB1 (0.44) —
SCHEMBL12612290 0.64 BRD4 (0.37) —
SCHEMBL15974005 0.64 KMT2A (0.42) —

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-7847096-B2 4-aminophenylmorpholinone derivatives and their preparation SALTIGO GMBH (DE) 2010-12-07 — — US disclosed
US-20090018126-A1 4-Aminophenylmorpholinone Derivatives and Their Preparation SALTIGO GMBH (DE) 2009-01-15 — — US disclosed
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