SCHEMBL7182960

SCHEMBL7182960

COc1cc(Cn2c(=O)n([C@H]3CC[C@H](O)CC3)c3ccc(C#N)cc32)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 8/20 0.44
PDE7B Q9NP56 3/20 0.44
DRD4 P21917 2/20 0.42
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
PDE5A O76074 4/20 0.40
PDE2A O00408 2/20 0.40
TP53 P04637 1/20 0.39
MDM2 Q00987 1/20 0.39
EP300 Q09472 1/20 0.38
PDE8A O60658 1/20 0.37
ALK Q9UM73 1/20 0.37
C5AR1 P21730 1/20 0.37
PPARG P37231 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
SCHEMBL7182967 1.00 PDE7A (0.44) PDE7APDE7BDRD4PRMT5WDR77
SCHEMBL7185263 0.93 PDE5A (0.47) PDE7APDE7BDRD4PRMT5WDR77
SCHEMBL7178553 0.93 PDE5A (0.47) PDE7APDE7BDRD4PRMT5WDR77
SCHEMBL7178544 0.93 PDE5A (0.47) PDE7APDE7BDRD4PRMT5WDR77
SCHEMBL7178489 0.92 PDE7A (0.51) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7176998 0.92 PDE7A (0.51) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7177007 0.92 PDE7A (0.51) PDE7APDE7BPRMT5WDR77PDE5A
SCHEMBL7183760 0.89 MTHFD2 (0.40) PRMT5WDR77C5AR1
SCHEMBL7183765 0.89 MTHFD2 (0.40) PRMT5WDR77C5AR1
SCHEMBL7184775 0.88 PDE7A (0.46) 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