SCHEMBL5120469

SCHEMBL5120469

CCOC(=O)CCc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1OCC(C)C

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 14/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 1/20 0.44
SCN10A Q9Y5Y9 2/20 0.42
PPARG P37231 1/20 0.41
HPGD P15428 1/20 0.41
LIPE Q05469 1/20 0.41

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
SCHEMBL5114166 0.90 MAPK1 (0.49) SCN9AMAPK1LMNASCN10AHPGD
SCHEMBL5108842 0.90 MAPK1 (0.49) SCN9AMAPK1LMNASCN10APPARG
SCHEMBL5120283 0.88 SCN9A (0.49) SCN9AMAPK1LMNASCN10APPARG
SCHEMBL5113018 0.87 PPARG (0.52) SCN9AMAPK1LMNAPPARGHPGD
SCHEMBL5121559 0.85 MAPK1 (0.52) SCN9AMAPK1LMNASCN10ALIPE
SCHEMBL5119944 0.84 MAPK1 (0.54) SCN9AMAPK1LMNASCN10AHPGD
SCHEMBL5113602 0.83 PPARG (0.49) SCN9AMAPK1LMNAPPARGHPGD
SCHEMBL5110082 0.83 MAPK1 (0.47) SCN9AMAPK1LMNASCN10ALIPE
SCHEMBL5121147 0.83 MAPK1 (0.45) SCN9AMAPK1LMNASCN10APPARG
SCHEMBL5121586 0.81 HPGD (0.48) SCN9AMAPK1LMNAHPGDLIPE

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-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 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-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 SCN9A 781/4885MAPK1 2249/4885LMNA 3761/4885

“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.