SCHEMBL7809663

SCHEMBL7809663

CCc1cccc2c(OS(=O)(=O)OC)c(C(C)=O)c(=O)[nH]c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.38
ALDH1A1 P00352 6/20 0.37
LMNA P02545 3/20 0.37
KDM4E B2RXH2 2/20 0.35
STING1 Q86WV6 1/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 3/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX15 P16050 1/20 0.33
NFKB1 P19838 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.33
DDO Q99489 1/20 0.33
PLA2G7 Q13093 1/20 0.32

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
SCHEMBL7809496 0.86 KDM4E (0.43) DAOALDH1A1LMNAKDM4EMEN1
SCHEMBL7813787 0.85 TUBB4A (0.39) DAOALDH1A1KDM4EMEN1KMT2A
SCHEMBL7804023 0.85 TUBB4A (0.39) DAOALDH1A1KDM4ECDK1CCNB1
SCHEMBL7817118 0.83 CAPN1 (0.42) ALDH1A1LMNAKDM4EHTTMEN1
SCHEMBL7803962 0.83 DAO (0.37) DAOALDH1A1KDM4EPLA2G7
SCHEMBL7809532 0.82 FEN1 (0.40) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL7809476 0.82 PLA2G7 (0.34) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL7809669 0.80 DAO (0.40) DAOALDH1A1LMNAKDM4ESTING1
SCHEMBL7809440 0.77 RXFP1 (0.40) DAOALDH1A1KDM4ECDK1CCNB1
SCHEMBL7804166 0.73 ALDH1A1 (0.44) ALDH1A1LMNAKDM4EMEN1KMT2A

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
EP-0533882-B1 2-QUINOLINONE DERIVATIVES, METHODS FOR PREPARING THE SAME AND FUNGICIDES AND INSECTICIDES INCLUDING THEM KOREA RES INST CHEM TECH (KR) 2001-02-07 EP disclosed
US-5430153-A Insecticides, fungicides KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-07-04 US disclosed
EP-0533882-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-03-31 EP disclosed
WO-1992017452-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-10-15 WO disclosed