SCHEMBL28686010

SCHEMBL28686010

CC(CC(=O)c1ccccc1)OC(=O)OO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
KMT2A Q03164 3/20 0.50
POLB P06746 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
HTT P42858 1/20 0.50
MEN1 O00255 2/20 0.49
NPC1 O15118 2/20 0.49
TSHR P16473 1/20 0.49
ALDH1A1 P00352 4/20 0.47
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 3/20 0.47
HPGD P15428 2/20 0.47
MAPK1 P28482 2/20 0.42
KDM4E B2RXH2 2/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
CES1 P23141 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL7720283 0.91 KMT2A (0.54) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL7720285 0.84 KMT2A (0.54) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL3789827 0.81 L3MBTL1 (0.47) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL28462932 0.81 KMT2A (0.51) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL10884799 0.79 KMT2A (0.61) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL3768812 0.75 KMT2A (0.51) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL3768811 0.75 KMT2A (0.51) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL9799560 0.74 TSHR (0.63) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL2026026 0.74 TSHR (0.63) L3MBTL1KMT2APOLBNPSR1HTT
SCHEMBL10793853 0.72 PDCD1 (0.54) KMT2AHTTMEN1NPC1TSHR

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-113924144-A Isopropyl carbonate benzoyl peroxide composition and using method thereof 高德美控股有限公司 2022-01-11 CN disclosed