SCHEMBL9801683

SCHEMBL9801683

CCCN1CCN(CCC(C)N)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.41
DRD2 P14416 7/20 0.38
SIGMAR1 Q99720 2/20 0.38
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
ALOX15 P16050 1/20 0.35
TP53 P04637 1/20 0.33
DRD3 P35462 1/20 0.33
KDM2B Q8NHM5 1/20 0.32

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
SCHEMBL9944698 0.91 ALOX15 (0.41) OPRM1GNAI3GNAO1GNAI1ALOX15
SCHEMBL9801731 0.86 OPRM1 (0.36) OPRM1SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL9800991 0.84 ALOX15 (0.36) OPRM1SIGMAR1ALOX15
SCHEMBL9801369 0.82 DRD2 (0.38) DRD2SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL9800972 0.82 ALOX15 (0.59) OPRM1SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL20959851 0.82 OPRM1 (0.41) OPRM1SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL13412960 0.81 DRD2 (0.41) DRD2SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL10658133 0.81 CARM1 (0.41)
SCHEMBL25947975 0.81
SCHEMBL991902 0.79 OPRM1 (0.31) OPRM1ALOX15

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-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed