SCHEMBL26544283

SCHEMBL26544283

NC1CCCN(C2CCCC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.39
SLC18A3 Q16572 1/20 0.38
OPRM1 P35372 3/20 0.38
OPRD1 P41143 2/20 0.38
OPRK1 P41145 2/20 0.38
OGFRL1 Q5TC84 2/20 0.38
DPP4 P27487 1/20 0.36
PHGDH O43175 1/20 0.35
MGLL Q99685 1/20 0.35
L3MBTL3 Q96JM7 4/20 0.34
L3MBTL1 Q9Y468 4/20 0.34
OPRL1 P41146 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
SCHEMBL26142133 0.93 OPRM1 (0.43) HTR6SLC18A3OPRM1OPRD1OPRK1
SCHEMBL1523992 0.93 HTR6 (0.42) HTR6SLC18A3OPRM1OPRD1OPRK1
SCHEMBL25748415 0.93 CYP2D6 (0.37) HTR6SLC18A3OPRM1OPRD1OPRK1
SCHEMBL1306715 0.93 SLC18A3 (0.42) HTR6SLC18A3OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL542930 0.90 SLC18A3 (0.41) HTR6SLC18A3OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL3951619 0.90 SLC18A3 (0.41) HTR6SLC18A3OPRM1OPRD1OPRK1
SCHEMBL550979 0.90 SLC18A3 (0.45) SLC18A3OPRM1OPRD1OPRK1OGFRL1
SCHEMBL31351060 0.90 SLC18A3 (0.45) SLC18A3OPRM1OPRD1OPRK1OGFRL1
SCHEMBL3958871 0.90 SLC18A3 (0.45) SLC18A3OPRM1OPRD1OPRK1OGFRL1
Hydrochloric Acid SCHEMBL28190168 0.88 SLC18A3 (0.44) SLC18A3OPRM1OPRD1OPRK1OGFRL1

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
EP-3244749-B1 PRODUCTION OF SOFT CONFECTIONERY BY MEANS OF ADDITIVE PROCESS WITH A NOZZLE REM3DY HEALTH LTD (GB) 2023-10-11 EP disclosed