SCHEMBL27831759

SCHEMBL27831759

CCCCC=CC(=O)ONC(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
ALDH1A1 P00352 1/20 0.45
FAAH O00519 3/20 0.40
ATM Q13315 1/20 0.38
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
SOAT1 P35610 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL8337805 0.82 HCAR2 (0.48) MAPTALDH1A1ATMRAB9ANPSR1
SCHEMBL8712030 0.82 HCAR2 (0.48) MAPTALDH1A1ATMRAB9ANPSR1
SCHEMBL2618106 0.81 MAPT (0.72) MAPTALDH1A1FAAHATMNPSR1
SCHEMBL1885350 0.81 MAPT (0.72) MAPTALDH1A1FAAHATMNPSR1
SCHEMBL4630838 0.78 MAPT (0.64) MAPTALDH1A1FAAHATMRAB9A
SCHEMBL4630840 0.78 MAPT (0.64) MAPTALDH1A1FAAHATMRAB9A
SCHEMBL1286418 0.78 HCAR2 (0.39) MAPTALDH1A1RAB9ANPSR1CYP1A2
SCHEMBL8711739 0.76 ATM (0.62) MAPTALDH1A1ATMRAB9ANPSR1
Phosphoric Acid SCHEMBL3668643 0.76 MAPT (0.66) MAPTALDH1A1FAAHATM
Phosphoric Acid SCHEMBL3668645 0.76 MAPT (0.66) MAPTALDH1A1FAAHATM

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
CN-101395186-B Radiation curable compositions CYTEC SURFACE SPECIALTIES SA 2011-04-13 CN disclosed