SCHEMBL11529933

SCHEMBL11529933

CC(C)(C)c1cc(C(=O)c2ccc([N+](=O)[O-])cc2)cc(C(C)(C)C)c1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.63
MEN1 O00255 1/20 0.63
GALR3 O60755 1/20 0.63
HTT P42858 1/20 0.63
KMT2A Q03164 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
NR1H4 Q96RI1 1/20 0.56
TDP1 Q9NUW8 2/20 0.55
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
SRD5A2 P31213 2/20 0.54
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
MAPK1 P28482 2/20 0.50
PTGS2 P35354 2/20 0.50
POLB P06746 1/20 0.50
ALOX5 P09917 1/20 0.50
PTGS1 P23219 1/20 0.50
CES1 P23141 1/20 0.47
ABCC3 O15438 1/20 0.47

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
SCHEMBL4985798 0.81 SMN1; SMN2 (0.58) L3MBTL1MEN1GALR3HTTKMT2A
SCHEMBL784936 0.80 ALOX5 (0.58) L3MBTL1MEN1HTTKMT2ASMN1; SMN2
SCHEMBL4322184 0.80 KMT2A (0.57) L3MBTL1MEN1GALR3HTTKMT2A
SCHEMBL8495448 0.80 ALOX5 (0.65) L3MBTL1MEN1GALR3HTTKMT2A
SCHEMBL4859122 0.80 MEN1 (0.69) L3MBTL1MEN1GALR3HTTKMT2A
SCHEMBL10559760 0.80 ALDH1A1 (0.73) L3MBTL1HTTTDP1ALDH1A1MAPT
SCHEMBL8461116 0.79 SRD5A2 (0.59) SMN1; SMN2TDP1SRD5A2LMNAGAA
SCHEMBL13057529 0.79 ALDH1A1 (0.57) SMN1; SMN2TDP1ALDH1A1SRD5A2LMNA
SCHEMBL2684424 0.79 SRD5A2 (0.62) L3MBTL1MEN1HTTKMT2ASMN1; SMN2
SCHEMBL3236587 0.78 MEN1 (1.00) L3MBTL1MEN1GALR3HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114149311-B Method for preparing 4-hydroxybenzophenone compound by taking p-methylene quinone as substrate 上海应用技术大学 2023-11-03 CN disclosed
CN-114149311-A Method for preparing 4-hydroxybenzophenone compound by taking p-methylenequinone as substrate 上海应用技术大学 2022-03-08 CN disclosed
US-4165383-A BENZOYL-2,6-DI(T-BUTYL)PHENOL AND DERIVATIVES RIKER LABORATORIES, INC. (US) 1979-08-21 US disclosed
US-4124725-A ADMINISTERING A 4-(AMINOBENZOYL)-2,6-DI-TERT-BUTYLPHENOL RIKER LABORATORIES, INC. (US) 1978-11-07 US disclosed