SCHEMBL9801677

SCHEMBL9801677

CCCN1CCN(CC(C)N)CC1C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.35
KCNJ1 P48048 1/20 0.33
KCNH2 Q12809 1/20 0.33
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8406332 0.87 ALOX15 (0.34) SIGMAR1KCNJ1KCNH2CYP2D6CYP2C19
SCHEMBL9801723 0.86 SIGMAR1 (0.46) SIGMAR1CYP2D6CYP2C19MEN1KMT2A
SCHEMBL9801365 0.86 MEN1 (0.35) SIGMAR1KCNJ1KCNH2CYP2D6CYP2C19
SCHEMBL9801806 0.83 SIGMAR1 (0.38) SIGMAR1KCNJ1KCNH2CYP2D6CYP2C19
SCHEMBL9801097 0.80 KCNJ1 (0.42) SIGMAR1KCNJ1KCNH2CYP2D6CYP2C19
SCHEMBL8406333 0.79 KDM4E (0.34)
SCHEMBL8406314 0.77 KCNJ1 (0.38) SIGMAR1KCNJ1KCNH2CYP2D6CYP2C19
SCHEMBL9801487 0.77 ALOX15 (0.43) SIGMAR1KCNJ1KCNH2CYP2D6CYP2C19
SCHEMBL9801281 0.77 MEN1 (0.38) SIGMAR1KCNH2CYP2D6CYP2C19MEN1
SCHEMBL8406331 0.77 ALOX15 (0.39) KCNJ1KCNH2CYP2D6CYP2C19MEN1

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