SCHEMBL17356407

SCHEMBL17356407

O=C(Oc1ccc(F)c(C(F)(F)F)c1)c1ccccc1F

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.65
POLB P06746 1/20 0.65
ESR1 P03372 1/20 0.57
ESR2 Q92731 1/20 0.57
KMT2A Q03164 5/20 0.54
ALDH1A1 P00352 4/20 0.54
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
KDM4E B2RXH2 1/20 0.51
ALOX15 P16050 1/20 0.51
ALOX12 P18054 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HTT P42858 1/20 0.46
TLR8 Q9NR97 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
CYP11B1 P15538 1/20 0.40
KAT6A Q92794 1/20 0.39
GRM4 Q14833 1/20 0.39

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
SCHEMBL4251281 0.87 MAPT (0.51) MAPTPOLBESR1ESR2KMT2A
SCHEMBL17356404 0.84 HIF1A (0.47) MAPTPOLBESR1ESR2KMT2A
SCHEMBL17356403 0.84 KMT2A (0.55) MAPTPOLBESR1ESR2KMT2A
SCHEMBL8758935 0.83 ESR1 (0.64) MAPTPOLBESR1ESR2KMT2A
SCHEMBL18697357 0.79 CDK8 (0.44) MAPTPOLBGRM4CDK8
SCHEMBL17352128 0.79 CDK8 (0.44) MAPTPOLBGRM4CDK8
SCHEMBL17352175 0.79 CDK8 (0.44) MAPTPOLBGRM4CDK8
SCHEMBL17356484 0.79 CA1 (0.42) MAPTPOLBGRM4CDK8
SCHEMBL17355725 0.79 MAPT (0.64) MAPTPOLBESR1ESR2KMT2A
SCHEMBL17356319 0.79 MAOB (0.46) MAPTPOLBTDP1GRM4CDK8

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 MAPT 4452/4885POLB 1891/4885ESR1 334/4885

“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.