SCHEMBL9801643

SCHEMBL9801643

CC(N)CN1CCN(CCCCO)CC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PAOX Q6QHF9 1/20 0.34
PIK3CD O00329 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL9800993 0.94 KMT2A (0.39) LMNAHTTKMT2AGNAI3GNAO1
SCHEMBL9801499 0.86 KMT2A (0.50) LMNAHTTKMT2ATP53PIK3CD
SCHEMBL9801261 0.82 SIGMAR1 (0.43) GNAI3GNAO1GNAI1SMN1; SMN2
SCHEMBL9801269 0.80 KEAP1 (0.47) SMN1; SMN2
SCHEMBL6680924 0.78
SCHEMBL1043849 0.78 PIK3CD (0.39) KMT2APIK3CDKDM4EALDH1A1
SCHEMBL11483699 0.78
SCHEMBL14258662 0.78 PIK3CD (0.48) LMNAHTTKMT2ATP53SMN1; SMN2
SCHEMBL11482886 0.76 HRH3 (0.52) GNAI3GNAO1GNAI1PAOXHRH3
SCHEMBL11899867 0.76 HRH3 (0.52) GNAI3GNAO1GNAI1PAOXHRH3

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