SCHEMBL7305569

SCHEMBL7305569

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

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
HIF1A Q16665 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
SCHEMBL25635649 0.78 ALDH1A1 (0.37) KDM4E
SCHEMBL12019810 0.77 ALDH1A1 (0.50)
SCHEMBL1492543 0.77 ALDH1A1 (0.50)
SCHEMBL11507418 0.74 SOAT1 (0.35) SOAT1KDM4EMAPK1HIF1A
SCHEMBL19014327 0.73 TDP1 (0.41)
SCHEMBL5597209 0.71 KDM4E (0.48) SOAT1KDM4EMAPK1HIF1A
SCHEMBL9073979 0.70 SLC7A5 (0.39) SOAT1
SCHEMBL9074201 0.68 SLC7A5 (0.46)
SCHEMBL23009650 0.68
SCHEMBL1902452 0.68 SLC22A6 (0.39)

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
EP-0509769-B1 Heterocyclic amides having HLE inhibiting activity ZENECA LTD (GB) 1996-09-11 EP disclosed