SCHEMBL7915136

SCHEMBL7915136

CC(C)(C)OC(=O)N1CCCC[C@H]1CN1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 1/20 0.51
HRH3 Q9Y5N1 2/20 0.48
OPRD1 P41143 1/20 0.45
KDM1A O60341 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL4794862 0.98 HRH3 (0.50) PDE8BHRH3OPRD1KDM1A
SCHEMBL5218137 0.97 PDE8B (0.48) PDE8BHRH3
SCHEMBL5218145 0.97 PDE8B (0.48) PDE8BHRH3
SCHEMBL7915142 0.95 HRH3 (0.50) PDE8BHRH3
SCHEMBL4714199 0.95 HRH3 (0.50) PDE8BHRH3
SCHEMBL4714197 0.95 HRH3 (0.50) PDE8BHRH3
SCHEMBL18461803 0.87 PDE8B (0.43) PDE8BHRH3OPRD1ATM
SCHEMBL4719547 0.86 SMN1; SMN2 (0.48) PDE8BHRH3ATM
SCHEMBL6304018 0.86 SMN1; SMN2 (0.48) PDE8BHRH3ATM
SCHEMBL4719550 0.86 SMN1; SMN2 (0.48) PDE8BHRH3ATM

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-6221865-B1 INHIBITORS OF PROTEIN FARNESYLTRANSFERASE AND PROTEIN GERANYLGERANYLTRANSFERASE. UNIVERSITY OF PITTSBURGH 2001-04-24 US disclosed