SCHEMBL2140734

SCHEMBL2140734

Nc1ccc(COC(=O)/C=C/c2ccc(OC(=O)c3ccc(OC(F)(F)C(F)F)cc3)cc2)c(N)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.33
MAPK1 P28482 1/20 0.33
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 2/20 0.33
HDAC1 Q13547 1/20 0.33
GAA P10253 1/20 0.33
MET P08581 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
F2 P00734 2/20 0.32
PRSS1 P07477 2/20 0.32
PRSS2 P07478 2/20 0.32

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
SCHEMBL28658369 1.00 MAPT (0.38) MAPTKDM4ELMNAMAPK1CA12
SCHEMBL28648613 0.94 MAPT (0.39) MAPTKDM4ELMNAMAPK1CA12
SCHEMBL2138812 0.94 MAPT (0.39) MAPTKDM4ELMNAMAPK1CA12
SCHEMBL28650120 0.93 MAPT (0.40) MAPTKDM4ELMNAMAPK1CA12
SCHEMBL1564456 0.93 MAPT (0.40) MAPTKDM4ELMNAMAPK1CA12
SCHEMBL2137177 0.91 MET (0.37) MAPTKDM4ELMNACA12CA9
SCHEMBL679370 0.91 MET (0.37) MAPTKDM4ELMNACA12CA9
SCHEMBL2138089 0.90 MET (0.36) MAPTKDM4ELMNACA12CA9
SCHEMBL2138706 0.88 MAPT (0.39) MAPTKDM4ELMNAMAPK1CA12
SCHEMBL28649268 0.88 MAPT (0.39) MAPTKDM4ELMNAMAPK1CA12

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-20110065859-A1 THERMALLY STABLE ALIGNMENT MATERIALS ROLIC AG (CH) 2011-03-17 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-20110065859-A1 THERMALLY STABLE ALIGNMENT MATERIALS PARG, PARN, PUF60 MAPT 159/4885KDM4E 2018/4885LMNA 771/4885

“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.