SCHEMBL8626528

SCHEMBL8626528

CC(=O)c1nc2ccc(S(=O)(=O)c3ccccc3)cc2cc1O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.43
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 4/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTR6 P50406 1/20 0.38
COMT P21964 1/20 0.38
PDE4B Q07343 1/20 0.37
GAA P10253 2/20 0.37
GFER P55789 1/20 0.37
HTR2A P28223 2/20 0.36
KCNH2 Q12809 2/20 0.36
HTR2C P28335 1/20 0.36

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
SCHEMBL6564105 0.80 EGLN1 (0.48) NAMPT
SCHEMBL8630298 0.78 SMN1; SMN2 (0.43) NAMPTMAPTKMT2AL3MBTL1SMN1; SMN2
Sulfuric Acid SCHEMBL29107938 0.77 ALDH1A1 (0.50) MAPTKDM4ELMNAMAPK1KMT2A
SCHEMBL6565253 0.77 TDP1 (0.43) MAPTKMT2AL3MBTL1SMN1; SMN2
SCHEMBL2975427 0.76 KDM4E (0.56) MAPTKDM4ELMNAMAPK1KMT2A
SCHEMBL8629451 0.73 EGLN1 (0.55)
SCHEMBL8632228 0.73 MEN1 (0.50) MAPTKDM4ELMNAMAPK1KMT2A
SCHEMBL6567169 0.73 ALDH1A1 (0.52) MAPTKDM4EMAPK1KMT2AALDH1A1
SCHEMBL22237927 0.72 ERN1 (0.37) KDM4EMAPK1KMT2AALDH1A1GAA
SCHEMBL6565240 0.72 RXFP1 (0.43) KDM4EKMT2AALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1120157-C Substituted quinoline-2-carboxamides, process for their preparation and their use as pharmaceuticals, and intermediates thereof FIBER GENE CORP (US) 2003-09-03 CN disclosed
CN-1282737-A Intermediate product used for preparing substituted quinoline-2-formamide MOECHST AG (DE) 2001-02-07 CN disclosed
US-5726305-A Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-10 US disclosed
US-5719164-A Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1998-02-17 US disclosed
CN-1154365-A Substituted quinoline-2-carboxamides, process for their preparation and their use as pharmaceuticals, and intermediates thereof HOECHST AG (DE) 1997-07-16 CN disclosed