SCHEMBL9148987

SCHEMBL9148987

COCC1(Nc2ccccc2)CCN(CCc2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPFFR1 Q9GZQ6 4/20 0.61
NPFFR2 Q9Y5X5 4/20 0.61
SMN1; SMN2 Q16637 1/20 0.57
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA4 P22748 3/20 0.50
CA5A P35218 3/20 0.50
CA7 P43166 3/20 0.50
CA9 Q16790 3/20 0.50
CA13 Q8N1Q1 3/20 0.50
CA14 Q9ULX7 3/20 0.50
OPRM1 P35372 2/20 0.50
OPRD1 P41143 1/20 0.50
OPRK1 P41145 1/20 0.50
SLC6A3 Q01959 1/20 0.46
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
SIGMAR1 Q99720 3/20 0.45
KCNH2 Q12809 1/20 0.45

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
Hydrochloric Acid SCHEMBL11565432 0.99 NPFFR1 (0.60) NPFFR1NPFFR2SMN1; SMN2CA12CA1
SCHEMBL11566761 0.93 NPFFR1 (0.54) NPFFR1NPFFR2SMN1; SMN2CA12CA1
SCHEMBL11564641 0.92 NPFFR1 (0.53) NPFFR1NPFFR2SMN1; SMN2SIGMAR1
SCHEMBL11566955 0.92 NPFFR1 (0.53) NPFFR1NPFFR2SMN1; SMN2CA12CA1
SCHEMBL11567248 0.92 SIGMAR1 (0.55) NPFFR1NPFFR2SMN1; SMN2OPRM1OPRD1
SCHEMBL11563945 0.92 NPFFR1 (0.53) NPFFR1NPFFR2SMN1; SMN2CA12CA1
SCHEMBL11566486 0.92 SIGMAR1 (0.55) NPFFR1NPFFR2SMN1; SMN2OPRM1OPRD1
SCHEMBL11567994 0.90 HRH3 (0.52) NPFFR1NPFFR2SMN1; SMN2CA12CA1
SCHEMBL11568096 0.89 SIGMAR1 (0.55) NPFFR1NPFFR2SMN1; SMN2OPRM1HTR1A
SCHEMBL3167579 0.86 NPFFR1 (0.60) NPFFR1NPFFR2OPRM1OPRK1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5420280-A Piperidin-4-spiro-oxiranes THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1995-05-30 US disclosed
EP-0523125-A1 NOVEL PIPERIDIN-4-SPIRO-OXIRANES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN (GB) 1993-01-20 EP disclosed
US-5145967-A Method for preparing 4-alkoxyalkyl-4-phenylaminopiperdines and derivatives thereof ANAQUEST, INC. (US) 1992-09-08 US disclosed
WO-1991015492-A1 NOVEL PIPERIDIN-4-SPIRO-OXIRANES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1991-10-17 WO disclosed
US-4179569-A ANALGESIC INTERMEDIATES JANSSEN PHARMACEUTICA N.V. (BE) 1979-12-18 US disclosed
US-3998834-A ANALGESICS JANSSEN PHARMACEUTICA N.V. (BE) 1976-12-21 US disclosed