SCHEMBL28944945

SCHEMBL28944945

COc1ccc(N(C)N=O)c(C(=O)c2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
LMNA P02545 4/20 0.56
HTT P42858 3/20 0.56
CYP1A2 P05177 3/20 0.56
HPGD P15428 3/20 0.56
CYP2C19 P33261 2/20 0.56
PGR P06401 1/20 0.56
CYP2D6 P10635 1/20 0.56
SLC6A2 P23975 1/20 0.56
PDE4A P27815 1/20 0.56
MAPK1 P28482 1/20 0.56
HRH1 P35367 1/20 0.56
SLC6A3 Q01959 1/20 0.56
PDE4D Q08499 1/20 0.56
POLB P06746 3/20 0.52
KMT2A Q03164 5/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 3/20 0.49

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
SCHEMBL28788383 0.83 KMT2A (0.56) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL28788379 0.81 GABRP (0.43) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL29587928 0.77 LMNA (0.66) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL28788371 0.76 ALDH1A1 (0.53) ALDH1A1LMNAHTTMAPK1POLB
SCHEMBL31366495 0.75 ALDH1A1 (0.67) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL4222291 0.75 MAPT (0.84) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL699230 0.75 ALDH1A1 (0.71) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL3480945 0.75 ALDH1A1 (0.71) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL2533157 0.75 ALDH1A1 (0.67) ALDH1A1LMNAHTTCYP1A2HPGD
SCHEMBL3902536 0.75 LMNA (0.77) ALDH1A1LMNAHTTCYP1A2HPGD

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
CN-114752955-B Method for electrochemically synthesizing N-nitroso-2-aminobenzophenone compound 广西师范大学 2023-06-16 CN disclosed
CN-114752955-A Method for electrochemically synthesizing N-nitroso-2-aminobenzophenone compound 广西师范大学 2022-07-15 CN disclosed