SCHEMBL5422579

SCHEMBL5422579

O/N=C\c1ccc(Nc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S100B P04271 1/20 0.59
▸ ALDH1A1 P00352 6/20 0.54
▸ L3MBTL1 Q9Y468 4/20 0.54
▸ HSD17B10 Q99714 3/20 0.54
▸ ALOX12 P18054 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ PTGS1 P23219 1/20 0.54
▸ SLC6A2 P23975 1/20 0.54
▸ PTGS2 P35354 1/20 0.54
▸ HTR2B P41595 1/20 0.54
▸ CYP3A4 P08684 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ KMT2A Q03164 5/20 0.48
▸ MAPT P10636 6/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ GAA P10253 2/20 0.47

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
SCHEMBL5422583 1.00 S100B (0.59) S100BALDH1A1L3MBTL1HSD17B10ALOX12
Benzaldehyde Oxime SCHEMBL220641 0.79 — —
Benzaldehyde Oxime SCHEMBL309201 0.79 — —
Benzaldehyde Oxime SCHEMBL266504 0.79 — —
SCHEMBL19018312 0.78 S100B (0.83) S100BALDH1A1L3MBTL1HSD17B10ALOX12
SCHEMBL30271866 0.78 S100B (0.83) S100BALDH1A1L3MBTL1HSD17B10ALOX12
SCHEMBL19379597 0.78 S100B (0.83) S100BALDH1A1L3MBTL1HSD17B10ALOX12
SCHEMBL25190699 0.77 ALDH1A1 (0.51) ALDH1A1L3MBTL1HSD17B10TDP1MAPK1
SCHEMBL26154817 0.77 MAPT (0.50) HTTKMT2AMAPTMEN1LMNA
SCHEMBL25190810 0.77 ALDH1A1 (0.43) S100BALDH1A1L3MBTL1ALOX12MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084645-B2 4-phenylamino-benzaldoxime derivatives and uses thereof as mitogen-activated protein kinase kinase (MEK) inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-12-27 — — US disclosed
US-8084645-B2 4-phenylamino-benzaldoxime derivatives and uses thereof as mitogen-activated protein kinase kinase (MEK) inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-12-27 — — US disclosed
US-20070105859-A1 4-Phenylamino-benzaldoxime derivatives and uses thereof as mitogen-activated protein kinase kinase (mek) inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-05-10 — — US disclosed
US-20070105859-A1 4-Phenylamino-benzaldoxime derivatives and uses thereof as mitogen-activated protein kinase kinase (mek) inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-05-10 — — US disclosed
EP-1674452-A1 NOVEL 4-PHENYLAMINO-BENZALDOXIME DERIVATIVE AND USE THEREOF AS MEK INHIBITOR CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-06-28 — — EP 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-20070105859-A1 4-Phenylamino-benzaldoxime derivatives and uses thereof as mitogen-activated protein kinase kinase (mek) inhibitors MAPK9, MAPK4, MAPK1 S100B 4209/4885ALDH1A1 1196/4885L3MBTL1 2127/4885

“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.

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