SCHEMBL2785941

SCHEMBL2785941

CC1(Cc2cc(F)cc(F)c2)C(=O)Nc2c(-c3cccc(N)n3)cc(-c3cccc(Cl)c3)cc21

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 12/20 0.47
▸ NOS2 P35228 1/20 0.33
▸ TDP2 O95551 1/20 0.32
▸ BACE1 P56817 4/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ CTSD P07339 2/20 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
SCHEMBL2786323 0.91 PGR (0.45) PGRNOS2TDP2PIK3CD
SCHEMBL2786310 0.88 PGR (0.46) PGRPIK3CD
SCHEMBL2785070 0.88 PGR (0.46) PGRTDP2PIK3CD
SCHEMBL2785604 0.86 PGR (0.50) PGRPIK3CD
SCHEMBL2785545 0.83 PGR (0.46) PGRPIK3CD
SCHEMBL2787876 0.77 HDAC1 (0.35) PGRPIK3CD
SCHEMBL2785852 0.77 PGR (0.41) PGRTDP2PIK3CD
SCHEMBL3016234 0.77 PGR (0.77) PGRPIK3CD
SCHEMBL2786464 0.73 PGR (0.39) PGRTDP2PIK3CD
SCHEMBL8808686 0.73 PGR (0.41) PGRNOS2BACE1CTSD

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
EP-2209373-A1 N-SUBSTITUTED OXINDOLINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS Merck Sharp & Dohme Corp. (US) 2010-07-28 — — EP claimed
WO-2009045386-A1 N-SUBSTITUTED OXINDOLINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS MERCK & CO., INC. (US) 2009-04-09 — — WO claimed
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