SCHEMBL3467779

SCHEMBL3467779

CC(C)(C)OC(=O)CC1Cc2cc(-c3ccc(Cl)c(Cl)c3)ccc2NC1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PYGL P06737 2/20 0.37
PYGM P11217 2/20 0.37
CRBN Q96SW2 1/20 0.37
SLC6A3 Q01959 6/20 0.33
MIF P14174 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
MAOB P27338 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR5 Q9H228 1/20 0.32
MAPK1 P28482 1/20 0.32
SLC6A4 P31645 4/20 0.32

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
SCHEMBL3467216 0.84 PYGL (0.41) PYGLPYGMPDE3BPDE3AMAOB
SCHEMBL3467771 0.84 KIF11 (0.48) CRBNMIF
SCHEMBL3466892 0.82 CYP11B1 (0.42) CRBNMIF
SCHEMBL3466516 0.81 BRD4 (0.39) CRBN
SCHEMBL3467584 0.77 BRD4 (0.36)
SCHEMBL3467229 0.75 FFAR1 (0.38) PYGLPYGM
SCHEMBL3468501 0.75 TDP2 (0.44)
SCHEMBL3466901 0.74 PGR (0.41) PDE3BPDE3A
SCHEMBL3466408 0.71 PGR (0.53)
SCHEMBL7073283 0.71 HSD17B1 (0.47) MIFMAPK1

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
WO-2010074807-A1 3, 4-DIHYDROQUINOLIN-2 ( 1H ) -ONE DERIVATIVES AS SODIUM CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-07-01 WO claimed
WO-2010074807-A1 3, 4-DIHYDROQUINOLIN-2 ( 1H ) -ONE DERIVATIVES AS SODIUM CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-07-01 WO disclosed