SCHEMBL17355672

SCHEMBL17355672

CCOP(=O)(OCC)C(F)(F)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PPARD Q03181 2/20 0.37
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
GAA P10253 2/20 0.34
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL10590583 0.84 TSHR (0.41) TSHRTP53TDP1PPARDCA12
SCHEMBL17860873 0.83 LMNA (0.33) GAAALDH1A1LMNACYP3A4
SCHEMBL16761027 0.81 CA12 (0.36) TSHRTP53TDP1PPARDCA12
SCHEMBL16761029 0.81 PKM (0.38) TSHRALDH1A1LMNAHSD17B10KDM4E
SCHEMBL17860871 0.79 CYP3A4 (0.48) TSHRALDH1A1CYP3A4
SCHEMBL25418055 0.78 TSHR (0.37) TSHRTP53TDP1PPARDGAA
SCHEMBL5663335 0.77 TSHR (0.40) TSHRTP53TDP1PPARDCA12
SCHEMBL28124907 0.77 CA12 (0.37) TSHRTP53TDP1PPARDCA12
Propene SCHEMBL28006038 0.77 TSHR (0.34) TSHRTP53TDP1PPARDCA12
SCHEMBL10588338 0.76 TP53 (0.41) TSHRTP53TDP1PPARDCA12

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-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 TSHR 3426/4885TP53 3874/4885TDP1 2884/4885

“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.