SCHEMBL28633889

SCHEMBL28633889

NC(=O)OC=CC(=O)OCOC(N)=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
MAPT P10636 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 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
SCHEMBL28645651 0.83 TSHR (0.38) ALOX15MAPTCACNA1BAPBA1
SCHEMBL28634410 0.80 ATM (0.44) ALOX15MAPTCACNA1BAPBA1
SCHEMBL24045655 0.77 HCAR2 (0.54) ALOX15MAPTCACNA1BAPBA1
SCHEMBL767783 0.74
SCHEMBL11298781 0.71 TSHR (0.48) ALOX15MAPTCACNA1BAPBA1
SCHEMBL21977964 0.71 NFE2L2 (0.55) ALOX15MAPT
SCHEMBL9747795 0.70 MAPT (0.41) ALOX15MAPTCACNA1BAPBA1
SCHEMBL14620032 0.69 ALOX15 (0.33) ALOX15
SCHEMBL8492180 0.69 HCAR2 (0.38) MAPT
SCHEMBL8492181 0.69 HCAR2 (0.38) MAPT

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-108472411-B High impact toughness transparent prosthetic materials with low residual MMA content 古莎有限公司 2021-10-01 CN disclosed