SCHEMBL7225274

SCHEMBL7225274

COC(=O)c1cc(OC)cc(OC)n1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
BACE1 P56817 1/20 0.45
CYP1A2 P05177 1/20 0.44
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 2/20 0.41
MAPT P10636 1/20 0.40
DYRK1A Q13627 1/20 0.40

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
SCHEMBL2973753 0.88 BACE1 (0.49) ALDH1A1KDM4EBACE1CYP1A2CYP3A4
SCHEMBL27882729 0.85 LMNA (0.46) ALDH1A1KDM4ECYP1A2LMNATDP1
SCHEMBL27541524 0.83 CYP1A2 (0.46) ALDH1A1KDM4ECYP1A2LMNATDP1
SCHEMBL987189 0.83 TDP1 (0.62) ALDH1A1KDM4ECYP1A2LMNATDP1
SCHEMBL23151971 0.81 LMNA (0.43) ALDH1A1KDM4ECYP1A2LMNATDP1
SCHEMBL28773734 0.81 SIRT6 (0.53) ALDH1A1KDM4ECYP1A2LMNATDP1
SCHEMBL19623132 0.81 GRM5 (0.51) ALDH1A1KDM4EBACE1CYP3A4HPGD
SCHEMBL17477633 0.81 CYP3A4 (0.46) ALDH1A1KDM4EBACE1CYP1A2CYP3A4
SCHEMBL30743068 0.81 LMNA (0.43) ALDH1A1KDM4ECYP1A2LMNATDP1
SCHEMBL30418230 0.81 CYP3A4 (0.46) ALDH1A1KDM4EBACE1CYP1A2CYP3A4

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
US-6610853-B1 N-(phenylsulfonyl)picolinamide derivatives, process for producing the same, and herbicide KUREHA KAGAKU KOGYO K.K. (JP) 2003-08-26 US disclosed
EP-1069112-A1 N-(PHENYLSULFONYL) PICOLINAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND HERBICIDE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2001-01-17 EP disclosed