SCHEMBL9801661

SCHEMBL9801661

CC(N)CN1CCN(CCO)CC1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.43
SIGMAR1 Q99720 2/20 0.34
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
KCNJ1 P48048 1/20 0.33
KCNH2 Q12809 1/20 0.33
MEN1 O00255 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPT P10636 1/20 0.30
RECQL P46063 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
SCHEMBL9801633 0.91 MAPK1 (0.35) MAPK1SIGMAR1KMT2AKCNJ1KCNH2
SCHEMBL8406331 0.85 ALOX15 (0.39) MAPK1KMT2AKCNJ1KCNH2MEN1
SCHEMBL9801365 0.84 MEN1 (0.35) SIGMAR1KMT2AKCNJ1KCNH2MEN1
SCHEMBL9801249 0.83 KEAP1 (0.33) MAPK1SIGMAR1KCNJ1KCNH2CYP2D6
SCHEMBL9801281 0.82 MEN1 (0.38) SIGMAR1KMT2AKCNH2MEN1KDM4E
SCHEMBL9801691 0.81 SIGMAR1 (0.38) SIGMAR1KMT2ALMNAL3MBTL1ALDH1A1
SCHEMBL7641908 0.81 MAPK1 (0.51) MAPK1SIGMAR1KMT2ALMNAHTT
SCHEMBL9801391 0.78 MAPK1 (0.50) MAPK1SIGMAR1KMT2AKCNJ1KCNH2
SCHEMBL8406334 0.78
SCHEMBL9801234 0.78 MAPK1 (0.49) MAPK1SIGMAR1KMT2ALMNAHTT

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