SCHEMBL17356459

SCHEMBL17356459

CC(C)(C)OC(=O)Oc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.51
CA2 P00918 1/20 0.41
AR P10275 1/20 0.41
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
CDK8 P49336 2/20 0.39
KDM1A O60341 1/20 0.39
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
TAS1R2 Q8TE23 2/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
KCNH2 Q12809 1/20 0.38
PLA2G7 Q13093 1/20 0.37
KCNN4 O15554 1/20 0.36
RORC P51449 2/20 0.36
EPHX2 P34913 1/20 0.35

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
SCHEMBL17352175 0.87 CDK8 (0.44) ARPOLBMAPTCDK8TAS1R3
SCHEMBL17352138 0.84 CDK8 (0.43) ARCDK8TAS1R3TAS1R1TAS1R2
SCHEMBL17286544 0.84 ELANE (0.57) ELANECA2POLBMAPTKDM1A
SCHEMBL18697357 0.84 CDK8 (0.44) ARPOLBMAPTCDK8TAS1R3
SCHEMBL17355760 0.82 POLB (0.40) ARPOLBMAPTCDK8TAS1R3
SCHEMBL17355754 0.81 ELANE (0.54) ELANECA2POLBMAPTKDM1A
SCHEMBL17356439 0.81 ELANE (0.51) ELANECA2ARPOLBMAPT
SCHEMBL1893249 0.81 LMNA (0.44) ARPOLBMAPTCDK8HTR2A
SCHEMBL17356427 0.81 KCNN4 (0.46) CA2ARPOLBMAPTCDK8
SCHEMBL17356478 0.81 ACACB (0.39) ARPOLBMAPTCDK8TAS1R3

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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 ELANE 570/4885CA2 286/4885AR 3255/4885

“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.