SCHEMBL7184352

SCHEMBL7184352

N#Cc1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](NC=O)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TNKS O95271 12/20 0.54
TNKS2 Q9H2K2 4/20 0.52
PARP2 Q9UGN5 3/20 0.51
PARP1 P09874 2/20 0.50
OPRM1 P35372 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.44
PGR P06401 3/20 0.43
HSD11B1 P28845 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 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
SCHEMBL7184358 1.00 TNKS (0.54) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL8242664 0.88 TNKS (0.64) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL15599564 0.86 TNKS (0.56) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL16444471 0.83 TNKS (0.62) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL16444469 0.83 TNKS (0.62) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL7178536 0.83 TNKS (0.59) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL20334018 0.83 TNKS (0.59) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL15289117 0.82 TNKS (0.59) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL16456031 0.82 TNKS (0.64) TNKSTNKS2PARP2PARP1OPRM1
SCHEMBL16456327 0.82 TNKS (0.64) TNKSTNKS2PARP2PARP1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6582351-B1 Benzimidazole heterocyclic compounds having pharmacological activities, and their use as a medicament for treatment or prevention of diseases mediated by cGMP-PDE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-24 US disclosed