SCHEMBL2881843

SCHEMBL2881843

CCOC(=O)c1ccc(C(F)(F)COS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
GAA P10253 1/20 0.55
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
POLB P06746 1/20 0.46
CYP2C9 P11712 1/20 0.45
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
PDK1 Q15118 1/20 0.43
PDK2 Q15119 1/20 0.43
PDK3 Q15120 1/20 0.43
PDK4 Q16654 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
ESR1 P03372 1/20 0.42
CA7 P43166 1/20 0.42
ESR2 Q92731 1/20 0.42
CA14 Q9ULX7 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL11037684 0.78 LMNA (0.61) KMT2AGAACA2CA9POLB
SCHEMBL21748815 0.77 MAPT (0.46) KMT2AGAAMAPTMEN1HTT
SCHEMBL8873186 0.75 KMT2A (0.58) KMT2AGAACA2CA9POLB
SCHEMBL581359 0.75 KMT2A (0.65) KMT2AGAACA2CA9POLB
SCHEMBL2883727 0.74 CA1 (0.56) KMT2AGAACA2CA9CYP2C9
SCHEMBL235800 0.73 CA2 (0.73) KMT2AGAACA2CA9MAPT
SCHEMBL10570963 0.72 KMT2A (0.43) KMT2AGAAPOLBMAPTMEN1
SCHEMBL13873578 0.72 GAA (0.54) KMT2AGAACA2CA9POLB
SCHEMBL19436459 0.72 GAA (0.43) KMT2AGAACA2CA9CYP2C9
SCHEMBL68796 0.72 GAA (0.43) KMT2AGAACA2CA9CYP2C9

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-20100216758-A1 Pyridone Compounds MSD K.K. (JP) 2010-08-26 US disclosed
EP-1916239-A1 PYRIDONE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-30 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-20100216758-A1 Pyridone Compounds NPY1R, MC5R, MC1R KMT2A 1658/4885GAA 3083/4885CA2 4358/4885

“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.