SCHEMBL8780262

SCHEMBL8780262

CC1=COC1=O.CCN(CC)CC

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPK1 P28482 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32
KMT2A Q03164 1/20 0.32
MCL1 Q07820 1/20 0.32
HKDC1 Q2TB90 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
DRD2 P14416 1/20 0.32
LMNA P02545 2/20 0.32

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
N,N-Dimethylethanaminium SCHEMBL8780265 0.86
SCHEMBL8022701 0.79
SCHEMBL10707134 0.76
Trimethylammonium SCHEMBL8993348 0.75 MEN1 (0.30) MAPTMEN1POLBKMT2AL3MBTL1
Ethylene Glycol SCHEMBL28720415 0.75 S100A4 (0.31)
SCHEMBL4824531 0.74 ALDH1A1 (0.31) ALDH1A1
Hydrochloric Acid SCHEMBL12094925 0.74 ACHE (0.31) BLM
SCHEMBL17501896 0.73
SCHEMBL16225377 0.72
SCHEMBL7644772 0.70

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0479245-B1 Absorbent polymer PHILLIPS PETROLEUM CO (US) 1997-03-05 EP claimed
EP-0479245-A2 Absorbent polymer PHILLIPS PETROLEUM COMPANY (US) 1992-04-08 EP claimed