SCHEMBL6820001

SCHEMBL6820001

Cc1ccc(C(CC=O)C(N)=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
LMNA P02545 3/20 0.40
EPHX1 P07099 2/20 0.40
STAT3 P40763 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLB P06746 1/20 0.39
ACHE P22303 1/20 0.39
ALDH1A1 P00352 6/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP13 P45452 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
PKM P14618 2/20 0.34
HTT P42858 2/20 0.34
ATM Q13315 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL1147878 0.84 POLB (0.50) LMNASTAT3CYP2C19POLBACHE
SCHEMBL6820157 0.82 KMT2A (0.42) LMNAEPHX1CYP2C19POLBMEN1
SCHEMBL6462542 0.82 EPHX1 (0.40) EPHX1ALDH1A1HTT
SCHEMBL6711147 0.81 EPHX1 (0.59) ALOX5LMNAEPHX1CYP2C19SMN1; SMN2
SCHEMBL16750534 0.79 ALOX5 (0.46) ALOX5LMNAEPHX1STAT3CYP2C19
SCHEMBL26898446 0.79 ALDH1A1 (0.50) ALOX5LMNAEPHX1CYP2C19POLB
SCHEMBL20826432 0.79 L3MBTL1 (0.54) LMNASTAT3POLBACHEALDH1A1
SCHEMBL6820306 0.79 SMN1; SMN2 (0.44) LMNACYP2C19POLBALDH1A1L3MBTL1
SCHEMBL2319893 0.79 STAT3 (0.39) ALOX5LMNASTAT3CYP2C19POLB
SCHEMBL30699923 0.78 CYP2C19 (0.51) ALOX5LMNAEPHX1STAT3CYP2C19

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
WO-2004026848-A1 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPERATION AND THEIR USE AS ANTIMYCOBACTERIAL AGENTS LUPIN LIMITED (IN) 2004-04-01 WO disclosed