SCHEMBL7345298

SCHEMBL7345298

O=C1OCC=C1CCC1CCC2(CC1)CCC(OCCN1CCCC1)CC2

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.35
MCHR1 Q99705 1/20 0.34

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
SCHEMBL7342773 0.81 NPC1 (0.35) NPC1MCHR1
SCHEMBL7337662 0.74 LTA4H (0.44) NPC1MCHR1
SCHEMBL7341127 0.73 GPR84 (0.39) NPC1
SCHEMBL7337816 0.73 LTA4H (0.46)
SCHEMBL7340086 0.72 LTA4H (0.44) NPC1MCHR1
Oxalic Acid SCHEMBL7347292 0.72 LTA4H (0.40) NPC1
SCHEMBL7345834 0.72 NPC1 (0.47) NPC1MCHR1
SCHEMBL7340702 0.71 NPC1 (0.41) NPC1
SCHEMBL7340699 0.71 NPC1 (0.41) NPC1
Hydrochloric Acid SCHEMBL7339927 0.70 NPC1 (0.40) NPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0578080-B1 3,9-disubstituted-spiro (5.5)undecanes active on the cardiovascular system, process for their preparation and pharmaceutical composition containing same SIGMA TAU IND FARMACEUTI (IT) 1997-04-23 EP claimed
EP-0578080-A2 3,9-disubstituted-spiro (5.5)undecanes active on the cardiovascular system, process for their preparation and pharmaceutical composition containing same Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 1994-01-12 EP claimed
EP-0578080-B1 3,9-disubstituted-spiro (5.5)undecanes active on the cardiovascular system, process for their preparation and pharmaceutical composition containing same SIGMA TAU IND FARMACEUTI (IT) 1997-04-23 EP disclosed
US-5444082-A Treats hypertension and heart failure SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 1995-08-22 US disclosed
EP-0578080-A2 3,9-disubstituted-spiro (5.5)undecanes active on the cardiovascular system, process for their preparation and pharmaceutical composition containing same Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 1994-01-12 EP disclosed