SCHEMBL16498157

SCHEMBL16498157

O=C(NC1N=C(c2c(Cl)cc(Cl)cc2Cl)c2ccccc2NC1=O)c1cc(F)ccc1OCc1cccnc1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 15/20 0.52
▸ LRRK2 Q5S007 2/20 0.49
▸ CCKAR P32238 8/20 0.48
▸ SGMS2 Q8NHU3 1/20 0.42

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
SCHEMBL16498605 0.94 CCKBR (0.48) CCKBRLRRK2CCKARSGMS2
SCHEMBL16498116 0.94 CCKBR (0.48) CCKBRLRRK2CCKAR
SCHEMBL16498256 0.92 CCKBR (0.54) CCKBRCCKAR
SCHEMBL16498542 0.90 CCKBR (0.53) CCKBRCCKAR
SCHEMBL16498244 0.88 CCKBR (0.55) CCKBRCCKAR
SCHEMBL16498214 0.86 CCKBR (0.50) CCKBRCCKAR
SCHEMBL16498250 0.86 CCKBR (0.48) CCKBRCCKAR
SCHEMBL16498269 0.86 CCKBR (0.48) CCKBRCCKAR
SCHEMBL16498212 0.86 CCKBR (0.48) CCKBRCCKAR
SCHEMBL16498283 0.85 CCKBR (0.49) CCKBRCCKAR

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-2011151651-A1 BENZODIAZEPINE COMPOUNDS USEFUL FOR THE TREATMENT OF HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2011-12-08 — — WO disclosed
WO-2011151651-A1 BENZODIAZEPINE COMPOUNDS USEFUL FOR THE TREATMENT OF HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2011-12-08 — — WO disclosed
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