SCHEMBL1925703

SCHEMBL1925703

CC(C)(C)OC(=O)C(C(=O)ON)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.42
KMT2A Q03164 4/20 0.42
LMNA P02545 1/20 0.42
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MMP8 P22894 1/20 0.40
AAK1 Q2M2I8 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MAPT P10636 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AOC3 Q16853 1/20 0.38
RECQL P46063 1/20 0.38
GRM6 O15303 1/20 0.38

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
SCHEMBL27756024 1.00 SRC (0.42) SRCKMT2ALMNAATML3MBTL1
SCHEMBL17965782 0.91 SRC (0.50) SRCKMT2ALMNAATML3MBTL1
SCHEMBL11523806 0.86 SRC (0.45) SRCKMT2ALMNAATML3MBTL1
SCHEMBL28305806 0.86 SRC (0.56) SRCKMT2ALMNAATML3MBTL1
SCHEMBL27352099 0.85 LMNA (0.41) KMT2ALMNACTSSCTSKALDH1A1
SCHEMBL5983603 0.84 SRC (0.57) SRCKMT2ALMNAATML3MBTL1
SCHEMBL28064960 0.84 SRC (0.57) SRCKMT2ALMNAATML3MBTL1
SCHEMBL3335866 0.84 SRC (0.57) SRCKMT2ALMNAATML3MBTL1
SCHEMBL16795576 0.82 MMP8 (0.60) KMT2AMMP8MEN1SMN1; SMN2
SCHEMBL1963340 0.81 ALDH1A1 (0.41) KMT2ALMNAATML3MBTL1CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2509941-A2 N-ACYLATED HYDROXYLAMINE DERIVATIVES AND O-ACYLATED HYDROXYLAMINE DERIVATIVES The Johns Hopkins University (US) 2012-10-17 EP disclosed
EP-2509942-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES Johns Hopkins University (US) 2012-10-17 EP disclosed
WO-2011071947-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 WO disclosed
WO-2011071951-A2 N-ACYLOXYSULFONAMIDE AND N-HYDROXY-N-ACYLSULFONAMIDE DERIVATIVES JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 WO disclosed
CN-101671310-A Compounds and compositions useful as cathepsin s inhibitors NOVARTIS AG 2010-03-17 CN disclosed
CN-101035768-A Compounds and compositions as cathepsin S inhibitors NOVARTIS AG (CH) 2007-09-12 CN disclosed
CN-1020340-C 1-carbacephalosporin antibiotics LILLY CO ELI (US) 1993-04-21 CN disclosed
CN-86108961-A 1-CARBACEPHALOSPORIN ANTIBIOTICS 1987-08-05 CN disclosed