SCHEMBL7686887

SCHEMBL7686887

COC(=O)c1ccccc1N(Br)S(C)(=O)=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.69
L3MBTL1 Q9Y468 2/20 0.51
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA5A P35218 1/20 0.49
CA9 Q16790 1/20 0.49
TSHR P16473 3/20 0.48
LMNA P02545 1/20 0.47
GAA P10253 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 2/20 0.46
CFTR P13569 1/20 0.46
HSD17B10 Q99714 1/20 0.46
POLB P06746 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.45
HPGD P15428 1/20 0.44
MAPK10 P53779 1/20 0.44
SLC6A3 Q01959 2/20 0.43
SLC6A4 P31645 1/20 0.43

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
SCHEMBL647372 0.82 KMT2A (1.00) KMT2AL3MBTL1CA1CA2CA5A
SCHEMBL4963622 0.78 KMT2A (0.66) KMT2AL3MBTL1CA1CA2CA5A
SCHEMBL30492227 0.77 KMT2A (0.64) KMT2AL3MBTL1CA1CA2CA5A
SCHEMBL13066502 0.77 KMT2A (0.64) KMT2AL3MBTL1CA1CA2CA5A
SCHEMBL4444645 0.75 KMT2A (0.67) KMT2AL3MBTL1CA1CA2CA5A
SCHEMBL29408467 0.75 KMT2A (0.67) KMT2AL3MBTL1CA1CA2CA5A
SCHEMBL43644 0.75 KMT2A (0.67) KMT2AL3MBTL1CA1CA2CA5A
SCHEMBL12513035 0.75 L3MBTL1 (0.61) KMT2AL3MBTL1TSHRLMNAALDH1A1
SCHEMBL29271836 0.74 KMT2A (0.65) KMT2AL3MBTL1CA1CA2CA5A
Dimethyl Phthalate SCHEMBL27641225 0.73 CA1 (0.63) KMT2AL3MBTL1CA1CA2CA5A

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-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides MUSIL TIBOR (GB) 2002-04-18 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-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides CBR3, CBR1, GLRA3 KMT2A 3499/4885L3MBTL1 2099/4885CA1 2603/4885

“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.