SCHEMBL9801762

SCHEMBL9801762

CCCN1CCN(CCCN)CC1CC

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.37
KEAP1 Q14145 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
CYP2D6 P10635 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33

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
SCHEMBL9801747 0.93 KEAP1 (0.37) SIGMAR1KEAP1SMN1; SMN2L3MBTL1CYP2D6
SCHEMBL9801817 0.92 KEAP1 (0.36) SIGMAR1KEAP1SMN1; SMN2L3MBTL1CYP2D6
SCHEMBL9801291 0.90 ALOX15 (0.41) SIGMAR1L3MBTL1GNAI3GNAO1GNAI1
SCHEMBL9801740 0.88 KEAP1 (0.36) SIGMAR1KEAP1SMN1; SMN2L3MBTL1CYP2D6
SCHEMBL9801496 0.86 SIGMAR1 (0.40) SIGMAR1KEAP1SMN1; SMN2L3MBTL1
SCHEMBL9801163 0.86 SIGMAR1 (0.36) SIGMAR1
SCHEMBL9801737 0.84 SIGMAR1 (0.39) SIGMAR1L3MBTL1
SCHEMBL9801612 0.83 SIGMAR1 (0.46) SIGMAR1L3MBTL1
SCHEMBL9801426 0.82 ALOX15 (0.44) SIGMAR1L3MBTL1GNAI3GNAO1GNAI1
SCHEMBL9801005 0.81 L3MBTL1 (0.34) SIGMAR1KEAP1SMN1; SMN2L3MBTL1

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