SCHEMBL6569429

SCHEMBL6569429

CC(C)OC(=N)c1cc[c]cc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.34
CA1 P00915 5/20 0.34
CA2 P00918 5/20 0.34
CA7 P43166 5/20 0.34
CA9 Q16790 5/20 0.34
CA14 Q9ULX7 5/20 0.34
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
AKR1B10 O60218 1/20 0.30
AKR1B1 P15121 1/20 0.30

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
SCHEMBL6571900 0.77 PDCD1 (0.32) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL10841241 0.77 PDCD1 (0.44) CA12CA1CA2CA7CA9
SCHEMBL3390194 0.76 PRSS1 (0.31)
SCHEMBL9212489 0.75 LMNA (0.40) CA12CA1CA2CA7CA9
SCHEMBL129051 0.75 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL6568927 0.75 ALDH1A1 (0.38)
SCHEMBL7974910 0.74 HPGD (0.38) CA12CA1CA2CA7CA9
SCHEMBL6569369 0.71 ELANE (0.32)
SCHEMBL6570040 0.71 DGAT1 (0.49) CA12CA1CA2CA7CA9
SCHEMBL27634820 0.68 LMNA (0.39)

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
EP-0463488-B2 O-Benzyl oxime ethers and fungicides containing them BASF AG (DE) 2004-04-21 EP claimed
CN-1791569-A Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof BAYER CROPSCIENCE AG (DE) 2006-06-21 CN disclosed