SCHEMBL21551689

SCHEMBL21551689

Cc1cccc(OC(=O)C(N)=O)c1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.53
MAPT P10636 3/20 0.49
ACHE P22303 1/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HTR1B P28222 1/20 0.39
KEAP1 Q14145 1/20 0.38

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
SCHEMBL6537087 0.88 POLB (0.59) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL21551645 0.85 ATM (0.45) MAPTRAB9AL3MBTL1LMNAMEN1
SCHEMBL473084 0.85 POLB (0.56) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL31498232 0.85 POLB (0.56) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL6537089 0.83 POLB (0.54) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL3192492 0.81 POLB (0.53) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL11341684 0.81 POLB (0.53) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL29525400 0.80 POLB (0.59) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL1803105 0.80 POLB (0.59) POLBMAPTACHERAB9AL3MBTL1
SCHEMBL6883692 0.80 POLB (0.51) POLBMAPTACHERAB9AL3MBTL1

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
WO-2019216355-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL 高砂香料工業株式会社 (JP) 2019-11-14 WO disclosed