SCHEMBL6579263

SCHEMBL6579263

CCCCCCCCOc1c(O)c2cccc(NC(=O)/C=C/c3cc(OC)c(O)c(OC)c3)c2n(C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.43
HTR2C P28335 2/20 0.43
HTR2A P28223 1/20 0.43
SLC6A4 P31645 1/20 0.43
HTR7 P34969 1/20 0.43
HTR6 P50406 1/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
CYSLTR2 Q9NS75 3/20 0.42
CYSLTR1 Q9Y271 3/20 0.42
KDM1A O60341 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL6579269 1.00 HTR1A (0.43) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL7977910 0.88 HTR1A (0.43) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL7977908 0.88 HTR1A (0.43) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL6582144 0.84 HTT (0.46) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL6582148 0.84 HTT (0.46) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL1710165 0.83 HTT (0.45) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL7997920 0.83 HTT (0.45) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL1710168 0.83 HTT (0.45) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL7997918 0.83 HTT (0.45) HTR1AHTR2CHTR2ASLC6A4HTR7
SCHEMBL2185931 0.82 ALDH1A1 (0.44) HTR1AHTR2CHTR2ASLC6A4HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1161337-C Chinolinelone derivative, its prepn. method and antiabnormal reaction agent ���ձ���ī��ѧ��ҵ��ʽ���� 2004-08-11 CN disclosed
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed
CN-1221738-A Chinolinelone derivative, its prepn. method and antiabnormal reaction agent DAINIPPON INK & CHEMICALS (JP) 1999-07-07 CN disclosed