SCHEMBL17352175

SCHEMBL17352175

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

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 2/20 0.44
KMO O15229 2/20 0.40
AR P10275 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
KCNH2 Q12809 1/20 0.40
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
GRM4 Q14833 1/20 0.39
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
TAS1R2 Q8TE23 2/20 0.38
PLA2G7 Q13093 1/20 0.38
NOTUM Q6P988 1/20 0.38
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
KCNE1 P15382 1/20 0.37
KCNQ1 P51787 1/20 0.37
ACACB O00763 1/20 0.37

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
SCHEMBL17356450 0.92 MAOB (0.46) CDK8KMOARPOLBMAPT
SCHEMBL17355760 0.91 POLB (0.40) CDK8KMOARHTR2ASLC6A4
SCHEMBL17352138 0.90 CDK8 (0.43) CDK8ARHTR2ASLC6A4KCNH2
SCHEMBL18697357 0.89 CDK8 (0.44) CDK8KMOARHTR2ASLC6A4
SCHEMBL17352128 0.89 CDK8 (0.44) CDK8KMOARHTR2ASLC6A4
SCHEMBL17356459 0.87 ELANE (0.51) CDK8ARHTR2ASLC6A4KCNH2
SCHEMBL17356452 0.87 CDK8 (0.39) CDK8KMOARHTR2ASLC6A4
SCHEMBL17356475 0.86 CDK8 (0.39) CDK8KMOARHTR2ASLC6A4
SCHEMBL17356427 0.86 KCNN4 (0.46) CDK8ARHTR2ASLC6A4KCNH2
SCHEMBL17356478 0.86 ACACB (0.39) CDK8ARHTR2ASLC6A4KCNH2

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 3 patents. 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 claimed
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 US disclosed
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 CDK8 4065/4885KMO 1832/4885AR 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.