SCHEMBL7184020

SCHEMBL7184020

COc1ccc(Cn2c(=O)n([C@@H]3CCNC3)c3ccc(C#N)cc32)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.42
PDE7A Q13946 3/20 0.41
PDE7B Q9NP56 2/20 0.41
GNRHR P30968 1/20 0.41
PDE5A O76074 13/20 0.39
PDE2A O00408 2/20 0.39
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
UTS2R Q9UKP6 1/20 0.38

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
SCHEMBL7185661 1.00 DRD4 (0.42) DRD4PDE7APDE7BGNRHRPDE5A
SCHEMBL7184027 1.00 DRD4 (0.42) DRD4PDE7APDE7BGNRHRPDE5A
SCHEMBL7183853 0.95 PDE7A (0.44) DRD4PDE7APDE7BPDE5APDE2A
SCHEMBL7183896 0.89 PDE7A (0.45) DRD4PDE7APDE7BPDE5APDE2A
SCHEMBL7182981 0.88 PDE7A (0.45) DRD4PDE7APDE7BPDE5APDE2A
SCHEMBL7192181 0.88 PDE7A (0.45) DRD4PDE7APDE7BPDE5APDE2A
SCHEMBL7178544 0.88 PDE5A (0.47) DRD4PDE7APDE7BPDE5APDE2A
SCHEMBL7178238 0.88 PDE1A (0.46) DRD4PDE7APDE7BPDE5APDE2A
SCHEMBL7178553 0.88 PDE5A (0.47) DRD4PDE7APDE7BPDE5APDE2A
SCHEMBL7185263 0.88 PDE5A (0.47) DRD4PDE7APDE7BPDE5APDE2A

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 3 patents. 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
EP-1196391-A1 BENZIMIDAZOLONE DERIVATIVES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-17 EP disclosed
WO-2001005770-A1 BENZIMIDAZOLONE DERIVATIVES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-25 WO disclosed