SCHEMBL2138706

SCHEMBL2138706

CC(F)(F)C(F)(F)Oc1ccc(C(=O)Oc2ccc(/C=C/C(=O)OCc3ccc(N)cc3N)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
NR1H4 Q96RI1 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
APP P05067 1/20 0.34
MET P08581 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
NTSR1 P30989 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CASP3 P42574 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL28649268 1.00 MAPT (0.39) MAPTKDM4ENR1H4KMT2AMEN1
SCHEMBL2137355 0.94 MAPT (0.40) MAPTKDM4ENR1H4KMT2AMEN1
SCHEMBL28648636 0.94 MAPT (0.40) MAPTKDM4ENR1H4KMT2AMEN1
SCHEMBL28650120 0.92 MAPT (0.40) MAPTKDM4ENR1H4KMT2ALMNA
SCHEMBL1564456 0.92 MAPT (0.40) MAPTKDM4ENR1H4KMT2ALMNA
SCHEMBL2136564 0.91 MET (0.38) MAPTKDM4ENR1H4LMNAMAPK1
SCHEMBL2140734 0.88 MAPT (0.38) MAPTKDM4ENR1H4KMT2AMEN1
SCHEMBL28658369 0.88 MAPT (0.38) MAPTKDM4ENR1H4KMT2AMEN1
SCHEMBL2138858 0.86 MAPT (0.41) MAPTKDM4ENR1H4KMT2AMEN1
SCHEMBL28667421 0.86 MAPT (0.39) MAPTKDM4ENR1H4KMT2ALMNA

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 2018/4885NR1H4 3670/4885

“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.