SCHEMBL28580976

SCHEMBL28580976

O=C(OCc1ccc(C(=O)c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.79
TDP1 Q9NUW8 3/20 0.79
SLC6A2 P23975 1/20 0.79
SLC6A3 Q01959 1/20 0.79
LMNA P02545 3/20 0.71
MEN1 O00255 1/20 0.67
ALDH1A1 P00352 8/20 0.62
MAPT P10636 5/20 0.62
HTT P42858 4/20 0.62
CYP2C9 P11712 3/20 0.62
CYP2C19 P33261 3/20 0.62
HPGD P15428 3/20 0.62
NPSR1 Q6W5P4 3/20 0.62
RAB9A P51151 5/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
NPC1 O15118 3/20 0.60
CYP3A4 P08684 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
CYP1A2 P05177 1/20 0.60
ATM Q13315 1/20 0.55

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
SCHEMBL5085718 0.92 KMT2A (0.92) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL6274205 0.89 KMT2A (0.79) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzyl Benzoate SCHEMBL8010992 0.88 KMT2A (1.00) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL312287 0.88 KMT2A (0.92) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzyl Benzoate SCHEMBL3038 0.88 KMT2A (1.00) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzyl Benzoate SCHEMBL901058 0.88 KMT2A (1.00) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL2238592 0.87 LMNA (0.86) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzyl Benzoate SCHEMBL29144647 0.86 KMT2A (0.96) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzyl Benzoate SCHEMBL28370886 0.86 KMT2A (0.96) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzyl Benzoate SCHEMBL29101943 0.86 KMT2A (0.96) KMT2ATDP1SLC6A2SLC6A3LMNA

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-113056255-A Ultraviolet screening agent composition containing cerium oxide particles having surface defects and method for preparing the same 秀博瑞殷株式公社 2021-06-29 CN disclosed