SCHEMBL7184775

SCHEMBL7184775

COc1ccc(Cn2c(=O)n([C@H]3CC[C@H](O)CC3)c3ccc(C#N)cc32)cc1C#N

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 8/20 0.46
PDE7B Q9NP56 3/20 0.46
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
PDE5A O76074 4/20 0.39
PDE2A O00408 2/20 0.39
C5AR1 P21730 2/20 0.39
S1PR1 P21453 1/20 0.38
DPP4 P27487 1/20 0.38
TP53 P04637 1/20 0.38
MDM2 Q00987 1/20 0.38
PDE8A O60658 1/20 0.38
CACNA1H O95180 1/20 0.37
EP300 Q09472 1/20 0.36

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
SCHEMBL7184780 1.00 PDE7A (0.46) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7176998 0.93 PDE7A (0.51) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7178489 0.93 PDE7A (0.51) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7177007 0.93 PDE7A (0.51) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7191384 0.91 PDE7A (0.44) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7191380 0.91 PDE7A (0.44) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7179525 0.90 PDE7A (0.44) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7185263 0.90 PDE5A (0.47) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7191389 0.90 PDE7A (0.44) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7178544 0.90 PDE5A (0.47) PDE7APDE7BPRMT5WDR77PDE5A

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