SCHEMBL6913439

SCHEMBL6913439

O=C(O)C(O)(CF)C(F)CF

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 1/20 0.35
ACLY P53396 1/20 0.35

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
SCHEMBL6907593 0.71 TSHR (0.39)
SCHEMBL6915706 0.71 ODC1 (0.32)
SCHEMBL6912715 0.70 TET2 (0.32) CPT2ACLY
SCHEMBL28715574 0.68 TSHR (0.35)
SCHEMBL29180660 0.67 ODC1 (0.36)
SCHEMBL21295134 0.64 PGD (0.34)
SCHEMBL7807777 0.63 CPT2 (0.37) CPT2ACLY
SCHEMBL6911617 0.63 CPT2 (0.37) CPT2ACLY
SCHEMBL6911619 0.63 CPT2 (0.37) CPT2ACLY
SCHEMBL11874359 0.62

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-6818423-B2 LOW-MOLECULAR-WEIGHT C4-C6-KETONES DERIVATIZED WITH REMOVABLE GROUP ARE REACTED WITH CYANIDE GROUP DONOR IN PRESENCE OF HYDROXYNITRILE LYASE OR BY RACEMIC REACTION, ACIDIC HYDROLYSIS, OPTIONALLY RESOLUTION, AND CLEAVAGE OF THE GROUP DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AU) 2004-11-16 US disclosed
US-20030092142-A1 Process for the preparation of chiral alpha-hydroxycarboxylic acids DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) 2003-05-15 US disclosed