SCHEMBL7226541

SCHEMBL7226541

COc1ccc(C(=O)Oc2ccccc2)nc1C

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
MAPT P10636 10/20 0.55
ALDH1A1 P00352 5/20 0.50
GAA P10253 3/20 0.43
CYP1A2 P05177 1/20 0.43
RECQL P46063 1/20 0.43
POLB P06746 3/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
NPC1 O15118 1/20 0.42
MAPK1 P28482 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 2/20 0.41
XBP1 P17861 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
SCHEMBL7225724 0.85 MAPT (0.51) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL7225728 0.84 MAPT (0.50) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL7234000 0.84 MAPT (0.50) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL14918993 0.80 KDM4E (0.71) KDM4EL3MBTL1MAPTALDH1A1CYP1A2
SCHEMBL7225742 0.79 KDM4E (1.00) KDM4EL3MBTL1MAPTALDH1A1RAB9A
SCHEMBL7227892 0.75 ALDH1A1 (0.52) KDM4EMAPTALDH1A1GAAPOLB
SCHEMBL16173477 0.75 KDM4E (0.73) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL69458 0.75 MAPT (0.75) KDM4EMAPTALDH1A1GAACYP1A2
SCHEMBL11908685 0.73 POLB (0.47) KDM4EL3MBTL1MAPTALDH1A1GAA
SCHEMBL7233982 0.72 KMT2A (0.55) KDM4EL3MBTL1MAPTALDH1A1GAA

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