SCHEMBL13858005

SCHEMBL13858005

O=C(O)NCC(=O)NCC(F)F

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL6720564 0.83
SCHEMBL4650825 0.78 CYP2D6 (0.37) CYP2D6CYP2C19
SCHEMBL24393370 0.77 CA1 (0.35) CYP2D6CYP2C19
SCHEMBL18628613 0.71
SCHEMBL13857912 0.71
SCHEMBL7636016 0.71
SCHEMBL2034726 0.71 MMP2 (0.34)
SCHEMBL10067714 0.70 EGLN1 (0.41) CYP2D6CYP2C19
Hydrochloric Acid SCHEMBL13858007 0.70 MMP2 (0.42) CYP2C19
SCHEMBL21012046 0.69 MCL1 (0.44) CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2710000-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS Eli Lilly and Company (US) 2014-03-26 EP disclosed
WO-2012155676-A1 PARASITICIDAL COMPOUNDS, METHODS, AND FORMULATIONS ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed
WO-2012158396-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed