SCHEMBL6806734

SCHEMBL6806734

C=CCc1cccc(O)c1C=NO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.49
GABRB2 P47870 2/20 0.49
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 0.45
MAPT P10636 4/20 0.45
GAA P10253 4/20 0.45
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 2/20 0.45
CASP1 P29466 1/20 0.45
HSD17B10 Q99714 1/20 0.45
AKR1B1 P15121 1/20 0.42
LMNA P02545 2/20 0.41
ALOX12 P18054 1/20 0.41
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
MAPK1 P28482 1/20 0.37
HPGD P15428 1/20 0.36
AURKA O14965 1/20 0.35
DAPK3 O43293 1/20 0.35
MAP4K4 O95819 1/20 0.35

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
SCHEMBL8163478 0.82 GABRA1 (0.55) GABRA1GABRB2KMT2AMEN1MAPT
SCHEMBL5454241 0.81 GABRA1 (0.43) GABRA1GABRB2KMT2AMEN1MAPT
SCHEMBL5227993 0.81 GABRA1 (0.43) GABRA1GABRB2KMT2AMEN1MAPT
SCHEMBL4704501 0.79 GABRA1 (0.52) GABRA1GABRB2KMT2AMEN1MAPT
SCHEMBL166586 0.79 GABRA1 (0.52) GABRA1GABRB2KMT2AMEN1MAPT
SCHEMBL15677707 0.77 KDM4E (0.47) KMT2AMEN1MAPTGAAKDM4E
SCHEMBL5074856 0.77 KDM4E (0.47) KMT2AMEN1MAPTGAAKDM4E
SCHEMBL5074857 0.77 KDM4E (0.47) KMT2AMEN1MAPTGAAKDM4E
SCHEMBL4453040 0.76 GABRA1 (0.49) GABRA1GABRB2KMT2AMEN1MAPT
SCHEMBL6823137 0.76 KMT2A (0.62) GABRA1GABRB2KMT2AMEN1MAPT

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-6673969-B2 REACTING MIXTURE OF ALKYL-SALICYL-ALDEHYDES OR ALKYL-SALICYL-KETONES WITH HYDROXYLAMINE SULFATE OR HYDROXYLAMINE HYDROCHLORIDE; FOR EXTRACTING GALLIUM FROM WASTE EFFLUENTS FROM ORE PROCESSING, SUCH AS BAYER LIQUOR COMSELHO NACIONAL DE DESENVOLVIMENTO CIENTIFICO E TECNOLOGICO CNPQ (BR) 2004-01-06 US disclosed
US-20020123650-A1 Process for preparation of oximes and resulting products CETEM - CENTRO DE TECNOLOGIA MINERAL (BR) 2002-09-05 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-20020123650-A1 Process for preparation of oximes and resulting products ACHE, LPO, GALE GABRA1 4722/4885GABRB2 4811/4885KMT2A 726/4885

“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.