SCHEMBL17356484

SCHEMBL17356484

O=C(Oc1ccc(F)c(C(F)(F)F)c1)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CDK8 P49336 2/20 0.40
TAS1R3 Q7RTX0 2/20 0.39
TAS1R1 Q7RTX1 2/20 0.39
TAS1R2 Q8TE23 2/20 0.39
NR1H4 Q96RI1 1/20 0.37
KMO O15229 2/20 0.36
AR P10275 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
KCNH2 Q12809 1/20 0.36
KCNQ3 O43525 1/20 0.36
KCNQ2 O43526 1/20 0.36
KCNE1 P15382 1/20 0.36
KCNQ1 P51787 1/20 0.36
GRM4 Q14833 1/20 0.35
NOTUM Q6P988 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
SCHEMBL17356409 0.82 MAPT (0.40) POLBMAPTCDK8TAS1R3TAS1R1
SCHEMBL17352128 0.82 CDK8 (0.44) POLBMAPTCDK8TAS1R3TAS1R1
SCHEMBL18697357 0.82 CDK8 (0.44) POLBMAPTCDK8TAS1R3TAS1R1
SCHEMBL17352175 0.82 CDK8 (0.44) POLBMAPTCDK8TAS1R3TAS1R1
SCHEMBL17356493 0.80 CES2 (0.44) POLBMAPTCDK8TAS1R3TAS1R1
SCHEMBL17356403 0.80 KMT2A (0.55) POLBMAPT
SCHEMBL17356408 0.80 EPHX2 (0.45) POLBMAPTCDK8TAS1R3TAS1R1
SCHEMBL17356407 0.79 MAPT (0.65) POLBMAPTCDK8GRM4
SCHEMBL17356486 0.79 PRSS1 (0.53) MAPTNR1H4
SCHEMBL17352150 0.79 MAOB (0.45) POLBMAPTCDK8TAS1R3TAS1R1

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 CA1 1448/4885CA2 286/4885POLB 1891/4885

“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.