SCHEMBL7480529

SCHEMBL7480529

NC(=O)C(O)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM8 O00222 1/20 0.34
GRM6 O15303 1/20 0.34
GRM4 Q14833 1/20 0.34
CES2 O00748 3/20 0.31
CES1 P23141 3/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL6830144 0.78 GRM8 (0.32) GRM8GRM6GRM4MEN1KMT2A
SCHEMBL7471164 0.76 GRM8 (0.39) GRM8GRM6GRM4CES2CES1
SCHEMBL6389061 0.72 EPHX1 (0.35) GRM8GRM6GRM4
SCHEMBL7464198 0.72 CES2 (0.62) CES2CES1
SCHEMBL7469784 0.70 LMNA (0.32)
SCHEMBL7080150 0.70 ALDH1A1 (0.32)
SCHEMBL8615396 0.64 GRM8 (0.32) GRM8GRM6GRM4
SCHEMBL407601 0.64
SCHEMBL7563688 0.64
SCHEMBL19735013 0.64 HDAC3 (0.45) CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077701-A4 ANTI-VIRAL COMPOUNDS LILLY CO ELI (US) 2002-03-20 EP disclosed
US-6358971-B1 FOR INHIBITING THE GROWTH OF A PICORNAVIRUS ELI LILLY AND COMPANY 2002-03-19 US disclosed
EP-1077701-A1 ANTI-VIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 2001-02-28 EP disclosed
WO-1999059587-A1 ANTI-VIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 1999-11-25 WO disclosed