SCHEMBL9524209

SCHEMBL9524209

COc1cccc(OC)c1N(N)C(C)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
TLR2 O60603 1/20 0.46
ERN1 O75460 1/20 0.46
TLR1 Q15399 1/20 0.46
TLR6 Q9Y2C9 1/20 0.46
NOTUM Q6P988 1/20 0.41
NFE2L2 Q16236 2/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 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
SCHEMBL27861432 0.80 CTSD (0.49) CA12CA1CA2CA7CA9
SCHEMBL7347321 0.74 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL23212275 0.74 ADORA2A (0.43) CA12CA1CA2CA7CA9
SCHEMBL30705345 0.73 CA12 (0.47) CA12CA1CA2CA7CA9
SCHEMBL9523367 0.72 CES2 (0.41) ERN1NOTUMALDH1A1KMT2A
SCHEMBL10441682 0.72 ALDH1A1 (0.40) NOTUMLMNAALDH1A1CYP3A4
SCHEMBL9021597 0.72 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL26086418 0.71 CA1 (0.46) CA12CA1CA2CA7CA9
SCHEMBL11398953 0.71 KDM4E (0.42) NFE2L2KDM4EALDH1A1MAPTHPGD
SCHEMBL12861290 0.70 SMN1; SMN2 (0.49) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0396769-B1 AZOXY COMPOUND KOWA CO. LTD. (JP) 1993-03-10 EP disclosed
US-5093480-A Fungicides KOWA COMPANY, LTD. (JP) 1992-03-03 US disclosed
EP-0396769-A1 AZOXY COMPOUND KOWA CO. LTD. (JP) 1990-11-14 EP disclosed