SCHEMBL4125657

SCHEMBL4125657

CCOC(=O)c1cc(OS(=O)(=O)C(F)(F)F)n(-c2ccccc2C)n1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
KMT2A Q03164 4/20 0.50
GAA P10253 1/20 0.50
TP53 P04637 3/20 0.48
THRB P10828 1/20 0.47
TDP1 Q9NUW8 2/20 0.45
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
CA9 Q16790 1/20 0.45
LMNA P02545 1/20 0.45
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
MAPK1 P28482 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
SCHEMBL3699441 0.91 MAPT (0.48) MAPTKMT2AGAATP53THRB
SCHEMBL3695927 0.91 TP53 (0.55) MAPTKMT2AGAATP53THRB
SCHEMBL20077903 0.90 KMT2A (0.48) MAPTKMT2AGAATP53THRB
SCHEMBL2838912 0.90 PDE4B (0.53) MAPTKMT2AGAATP53THRB
SCHEMBL3699652 0.88 THRB (0.48) MAPTKMT2AGAATP53THRB
SCHEMBL3695660 0.87 TP53 (0.51) MAPTKMT2AGAATP53THRB
SCHEMBL3695444 0.87 TP53 (0.51) MAPTKMT2AGAATP53THRB
SCHEMBL476291 0.86 TP53 (0.46) MAPTKMT2AGAATP53THRB
SCHEMBL3700028 0.85 KMT2A (0.44) MAPTKMT2AGAATP53THRB
SCHEMBL3701832 0.85 TP53 (0.46) MAPTKMT2AGAATP53THRB

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
EP-2190822-B1 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2014-12-31 EP disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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-20090156642-A1 5-Membered heterocyclic compound CEL, PGA5, COG5 MAPT 4258/4885KMT2A 4776/4885GAA 7/4885

“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.