SCHEMBL7915142

SCHEMBL7915142

CC(C)(C)OC(=O)N1CCC[C@H]1CN1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.50
PDE8B O95263 1/20 0.47
KCNH2 Q12809 3/20 0.45
HSD17B10 Q99714 1/20 0.45
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL4714197 1.00 HRH3 (0.50) HRH3PDE8BKCNH2HSD17B10HPGD
SCHEMBL4714199 1.00 HRH3 (0.50) HRH3PDE8BKCNH2HSD17B10HPGD
SCHEMBL5218145 0.98 PDE8B (0.48) HRH3PDE8BKCNH2HSD17B10SMN1; SMN2
SCHEMBL5218137 0.98 PDE8B (0.48) HRH3PDE8BKCNH2HSD17B10SMN1; SMN2
SCHEMBL4794862 0.97 HRH3 (0.50) HRH3PDE8BHPGD
SCHEMBL7915136 0.95 PDE8B (0.51) HRH3PDE8B
SCHEMBL18461803 0.89 PDE8B (0.43) HRH3PDE8BKCNH2HSD17B10SMN1; SMN2
SCHEMBL4719547 0.87 SMN1; SMN2 (0.48) HRH3PDE8BHSD17B10SMN1; SMN2
SCHEMBL4719550 0.87 SMN1; SMN2 (0.48) HRH3PDE8BHSD17B10SMN1; SMN2
SCHEMBL6304018 0.87 SMN1; SMN2 (0.48) HRH3PDE8BHSD17B10SMN1; SMN2

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