SCHEMBL4762263

SCHEMBL4762263

CC(C)(C)ON=O.COCc1nc(Cl)sc1C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 2/20 0.31
HPGD P15428 1/20 0.31
MAPT P10636 2/20 0.30
HSD17B10 Q99714 1/20 0.30
PTPN11 Q06124 1/20 0.30

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
SCHEMBL3119963 0.87 POLB (0.40) L3MBTL1ALDH1A1POLBKMT2ATSHR
SCHEMBL21702346 0.78 KMT2A (0.35) L3MBTL1ALDH1A1POLBKMT2ATSHR
SCHEMBL3620210 0.75 ALDH1A1 (0.42) L3MBTL1ALDH1A1POLBKMT2ATSHR
SCHEMBL9644333 0.73 ALDH1A1 (0.53) L3MBTL1ALDH1A1POLBKMT2ATSHR
SCHEMBL8524708 0.73 ALDH1A1 (0.50) L3MBTL1ALDH1A1KMT2ATSHRHPGD
SCHEMBL8485222 0.72 CDC7 (0.46) L3MBTL1ALDH1A1KMT2ATSHRHPGD
SCHEMBL2444646 0.69 L3MBTL1 (0.46) L3MBTL1ALDH1A1POLBKMT2ATSHR
SCHEMBL20439944 0.67 TSHR (0.43) L3MBTL1ALDH1A1POLBKMT2ATSHR
SCHEMBL1724016 0.66 ALDH1A1 (0.46) L3MBTL1ALDH1A1POLBKMT2ATSHR
SCHEMBL3119779 0.66 ALDH1A1 (0.40) L3MBTL1ALDH1A1POLBKMT2ATSHR

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
EP-1991545-A2 ANTIBACTERIAL PYRROLOPYRIDINES, PYRROLOPYRIMIDINES, AND PYRROLOAZEPINES AstraZeneca AB (SE) 2008-11-19 EP disclosed
WO-2007071965-A2 ANTIBACTERIAL PYRROLOPYRIDINES, PYRROLOPYRIMIDINES, AND PYRROLOAZEPINES ASTRAZENECA AB (SE) 2007-06-28 WO disclosed