SCHEMBL2786464

SCHEMBL2786464

CC1(Cc2cc(F)cc(F)c2)C(=O)Nc2c(-c3ccncc3)cc(-c3ccc(F)c(Cl)c3)cc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 12/20 0.39
▸ NR3C1 P04150 1/20 0.39
▸ NR3C2 P08235 1/20 0.39
▸ AR P10275 1/20 0.39
▸ PIK3CD O00329 3/20 0.35
▸ TDP2 O95551 1/20 0.35
▸ CDC7 O00311 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ PRKACA P17612 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ HIPK2 Q9H2X6 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35
▸ IRAK4 Q9NWZ3 1/20 0.35
▸ BUB1 O43683 1/20 0.33

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
SCHEMBL2784158 0.90 CACNA1B (0.39) PGRNR3C1NR3C2ARPIK3CD
SCHEMBL2784455 0.88 PGR (0.40) PGRNR3C1NR3C2ARPIK3CD
SCHEMBL2785852 0.86 PGR (0.41) PGRNR3C1NR3C2ARPIK3CD
SCHEMBL2785099 0.81 EPHX2 (0.42) PGRPIK3CD
SCHEMBL3014377 0.80 PGR (0.58) PGRNR3C1NR3C2ARPIK3CD
SCHEMBL2787297 0.77 PGR (0.49) PGRPIK3CDTDP2
SCHEMBL1948699 0.77 PGR (0.43) PGRNR3C1NR3C2ARTDP2
SCHEMBL2785545 0.76 PGR (0.46) PGRPIK3CD
SCHEMBL2785604 0.76 PGR (0.50) PGRPIK3CD
SCHEMBL2784159 0.75 PIK3CD (0.40) PGRPIK3CD

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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