SCHEMBL13620569

SCHEMBL13620569

COC(=O)Nc1cccc(OC(N)=O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.68
FAAH O00519 1/20 0.68
CYP3A4 P08684 1/20 0.68
MAPK1 P28482 1/20 0.68
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
CYP1A2 P05177 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
TP53 P04637 3/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
LMNA P02545 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HTT P42858 1/20 0.49
TSHR P16473 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
HPGD P15428 1/20 0.49
BCHE P06276 1/20 0.48
ACHE P22303 1/20 0.48
NLRP3 Q96P20 1/20 0.48

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
Toluene SCHEMBL27715168 0.92 CYP3A4 (0.71) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL5250387 0.85 MEN1 (0.61) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL4290909 0.85 MTNR1B (0.60) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL11191731 0.85 KMT2A (0.66) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL11382382 0.84 ALDH1A1 (0.78) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL11287110 0.84 ADORA3 (0.51) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL9576738 0.83 KMT2A (0.63) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL2096261 0.83 TP53 (0.68) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL2098030 0.82 ALDH1A1 (0.66) ALDH1A1FAAHCYP3A4MAPK1KMT2A
SCHEMBL11051091 0.82 CYP3A4 (0.74) ALDH1A1FAAHCYP3A4MAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120051208-A Comb polymers 诺力昂化学品国际有限公司 2025-05-27 CN disclosed
WO-2009133181-A1 ETHER-AMIDE TYPE COMPOUNDS, PREPARATION METHOD AND USES RHODIA OPERATIONS (FR) 2009-11-05 WO disclosed
WO-2009092795-A1 USE OF ESTER AMIDES AS SOLVENTS, ESTER AMIDES AS SUCH, AND METHOD FOR PREPARING ESTER AMIDES RHODIA OPERATIONS (FR) 2009-07-30 WO disclosed