SCHEMBL7185263

SCHEMBL7185263

COc1ccc(Cn2c(=O)n([C@H]3CC[C@H](O)CC3)c3ccc(C#N)cc32)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 13/20 0.47
PDE2A O00408 2/20 0.47
EP300 Q09472 1/20 0.44
PDE7A Q13946 3/20 0.44
PDE7B Q9NP56 2/20 0.44
DRD4 P21917 1/20 0.43
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
TP53 P04637 1/20 0.41
MDM2 Q00987 1/20 0.41

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
SCHEMBL7178553 1.00 PDE5A (0.47) PDE5APDE2AEP300PDE7APDE7B
SCHEMBL7178544 1.00 PDE5A (0.47) PDE5APDE2AEP300PDE7APDE7B
SCHEMBL7182967 0.93 PDE7A (0.44) PDE5APDE2AEP300PDE7APDE7B
SCHEMBL7182960 0.93 PDE7A (0.44) PDE5APDE2AEP300PDE7APDE7B
SCHEMBL7183896 0.93 PDE7A (0.45) PDE5APDE2APDE7APDE7BDRD4
SCHEMBL7184745 0.92 PDE7A (0.44) PDE5APDE2APDE7APDE7BDRD4
SCHEMBL7184738 0.92 PDE7A (0.44) PDE5APDE2APDE7APDE7BDRD4
SCHEMBL7182981 0.92 PDE7A (0.45) PDE5APDE2APDE7APDE7BDRD4
SCHEMBL7192181 0.92 PDE7A (0.45) PDE5APDE2APDE7APDE7BDRD4
SCHEMBL7176998 0.92 PDE7A (0.51) PDE5APDE2APDE7APDE7BPRMT5

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