SCHEMBL9800977

SCHEMBL9800977

CC(O)CN1CCN(CCCO)CC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
DRD2 P14416 4/20 0.42
DRD3 P35462 4/20 0.42
SLC6A3 Q01959 3/20 0.42
DRD4 P21917 2/20 0.42
TP53 P04637 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL9518405 0.87 LMNA (0.57) LMNAHTTKMT2ADRD2DRD3
SCHEMBL14258662 0.85 PIK3CD (0.48) LMNAHTTKMT2ATP53SMN1; SMN2
SCHEMBL17493164 0.83 MEN1 (0.46) KMT2ADRD2DRD3SLC6A3DRD4
SCHEMBL27867239 0.83 GNAI3 (0.47) DRD2DRD3SLC6A3DRD4
SCHEMBL17996818 0.82 DRD2 (0.47) KMT2ADRD2DRD3SLC6A3DRD4
SCHEMBL636364 0.82 DRD2 (0.47) KMT2ADRD2DRD3SLC6A3DRD4
SCHEMBL3970694 0.82 DRD2 (0.47) KMT2ADRD2DRD3SLC6A3DRD4
SCHEMBL8860654 0.82 DRD2 (0.47) KMT2ADRD2DRD3SLC6A3DRD4
SCHEMBL13833151 0.82 DRD2 (0.47) KMT2ADRD2DRD3SLC6A3DRD4
SCHEMBL5860445 0.82

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