SCHEMBL6792778

SCHEMBL6792778

CNC(=O)C(=NOC)c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.48
CA2 P00918 7/20 0.48
CA12 O43570 5/20 0.48
CA7 P43166 5/20 0.48
CA9 Q16790 5/20 0.48
CA14 Q9ULX7 5/20 0.48
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 3/20 0.38
CYP3A4 P08684 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.38
ESR1 P03372 3/20 0.38
ESR2 Q92731 2/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL27602847 1.00 CA1 (0.48) CA1CA2CA12CA7CA9
SCHEMBL8819049 0.84 TSHR (0.47) ALDH1A1MAPTHPGDCYP3A4TDP1
SCHEMBL563939 0.84 TSHR (0.47) ALDH1A1MAPTHPGDCYP3A4TDP1
SCHEMBL8539430 0.84 TSHR (0.47) ALDH1A1MAPTHPGDCYP3A4TDP1
SCHEMBL9043211 0.82 CA1 (0.52) CA1CA2CA12CA7CA9
SCHEMBL9043204 0.82 CA1 (0.52) CA1CA2CA12CA7CA9
SCHEMBL9659551 0.82 CA1 (0.52) CA1CA2CA12CA7CA9
SCHEMBL9659492 0.80 CA1 (0.48) CA1CA2CA12CA7CA9
SCHEMBL9659486 0.80 CA1 (0.48) CA1CA2CA12CA7CA9
SCHEMBL27585032 0.80 CA1 (0.44) CA1CA2CA12CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040186318-A1 Method for producing (2e)-2-(hydroxyphenyl-2-(alkoxyimino)-n-methylacetamides BAYER CROPSCIENCE AG (DE) 2004-09-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040186318-A1 Method for producing (2e)-2-(hydroxyphenyl-2-(alkoxyimino)-n-methylacetamides HMOX2, CYP1A2, PTGS2 CA1 1377/4885CA2 934/4885CA12 1990/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.