SCHEMBL6289513

SCHEMBL6289513

COC(C(N)=O)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.31
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 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
SCHEMBL14530110 0.81
SCHEMBL9196637 0.77 SLC1A3 (0.36) ACHESLC1A3SLC1A2SLC1A1
SCHEMBL6932001 0.77 SLC1A3 (0.36) ACHESLC1A3SLC1A2SLC1A1
SCHEMBL2466255 0.77 SLC1A3 (0.31) SLC1A3SLC1A2SLC1A1
SCHEMBL21916633 0.77 ALDH1A1 (0.32) ACHE
SCHEMBL6931998 0.77 SLC1A3 (0.36) ACHESLC1A3SLC1A2SLC1A1
SCHEMBL13484756 0.76
SCHEMBL21881710 0.75 ACHE (0.31) ACHE
SCHEMBL9162000 0.75 ACHE (0.31) ACHE
SCHEMBL8600469 0.75 ACHE (0.45) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007056279-A2 PHOSPHOLIPASE INHIBITORS, INCLUDING MULTI-VALENT PHOSPHOLIPASE INHIBITORS, AND USE THEREOF, INCLUDING AS LUMEN-LOCALIZED PHOSPHOLIPASE INHIBITORS ILYPSA, INC. (US) 2007-05-18 WO disclosed
WO-2007056184-A2 AZAINDOLE COMPOUNDS AND USE THEREOF AS PHOSPHOLIPASE-A2 INHIBITORS ILYPSA, INC. (US) 2007-05-18 WO disclosed
WO-2007056275-A2 INDOLE COMPOUNDS HAVING C4-AMIDE SUBSTITUENTS AND USE THEREOF AS PHOSPHOLIPASE-A2 INHIBITORS ILYPSA, INC. (US) 2007-05-18 WO disclosed
WO-2007056281-A2 MULTIVALENT INDOLE COMPOUNDS AND USE THEREOF AS PHOSPHOLIPASE-A2 INHIBITORS ILYPSA, INC. (US) 2007-05-18 WO disclosed
JP-2005194227-A METHOD FOR PRODUCING OPTICALLY ACTIVE 3,3,3-TRIFLUORO-2-HYDROXYPROPIONIC ACID DERIVATIVE CENTRAL GLASS CO LTD 2005-07-21 JP disclosed