SCHEMBL9801249

SCHEMBL9801249

CC(N)CN1CCN(CCCN)CC1C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KCNJ1 P48048 1/20 0.32
KCNH2 Q12809 1/20 0.32
SIGMAR1 Q99720 3/20 0.31
CYP2D6 P10635 2/20 0.31
HSD17B10 Q99714 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 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
SCHEMBL8406331 0.90 ALOX15 (0.39) KCNJ1KCNH2CYP2D6MAPK1CYP2C19
SCHEMBL9801633 0.86 MAPK1 (0.35) KCNJ1KCNH2SIGMAR1MAPK1
SCHEMBL9801649 0.83 KEAP1 (0.39) KEAP1SMN1; SMN2KCNJ1KCNH2SIGMAR1
SCHEMBL9801365 0.83 MEN1 (0.35) KCNJ1KCNH2SIGMAR1CYP2D6CYP2C19
SCHEMBL9801661 0.83 MAPK1 (0.43) KCNJ1KCNH2SIGMAR1CYP2D6MAPK1
SCHEMBL9801005 0.82 L3MBTL1 (0.34) KEAP1SMN1; SMN2SIGMAR1
SCHEMBL9801120 0.82 KCNJ1 (0.38) KEAP1SMN1; SMN2KCNJ1KCNH2SIGMAR1
SCHEMBL8406332 0.81 ALOX15 (0.34) KCNJ1KCNH2SIGMAR1CYP2D6CYP2C19
SCHEMBL9801503 0.80 SIGMAR1 (0.42) KEAP1SMN1; SMN2KCNJ1KCNH2SIGMAR1
SCHEMBL9801938 0.79 KCNJ1 (0.37) KEAP1SMN1; SMN2KCNJ1KCNH2SIGMAR1

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