SCHEMBL8816475

SCHEMBL8816475

COP(=O)(OC)C(OC(C)=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
CYP2C19 P33261 1/20 0.38
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL19398890 0.88 LMNA (0.40) LMNACYP2C19TDP1ALDH1A1
SCHEMBL8816418 0.83 LMNA (0.40) LMNACYP2C19
SCHEMBL19379179 0.81 GAA (0.39) LMNACYP2C19TSHRTDP1ALDH1A1
SCHEMBL8155340 0.81 TSHR (0.37) TSHRTDP1
SCHEMBL8373916 0.81 TSHR (0.37) TSHRTDP1
SCHEMBL8372103 0.81 TSHR (0.37) TSHRTDP1
SCHEMBL11430387 0.79 LMNA (0.61) LMNACYP2C19TSHRTDP1ALDH1A1
SCHEMBL8817881 0.79 LMNA (0.37) LMNACYP2C19
SCHEMBL8816553 0.76 LMNA (0.71) LMNACYP2C19ALDH1A1
SCHEMBL19398512 0.72 LMNA (0.39) LMNACYP2C19

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-20170275311-A1 NON-AQUEOUS LIQUID ELECTROLYTE, ELECTRICITY STORAGE DEVICE USING SAME, AND PHOSPHORUS COMPOUND USED THEREIN UBE INDUSTRIES, LTD. (JP) 2017-09-28 US disclosed
WO-1997039756-A1 USE OF PHOSPHONIC ACID ESTERS FOR THE TREATMENT OF FUNCTIONAL DISORDERS OF THE BRAIN AND DEPRESSION TROPONWERKE GMBH & CO. KG (DE) 1997-10-30 WO 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-20170275311-A1 NON-AQUEOUS LIQUID ELECTROLYTE, ELECTRICITY STORAGE DEVICE USING SAME, AND PHOSPHORUS COMPOUND USED THEREIN SCN10A, CACNA2D4, P2RY10 LMNA 1341/4885CYP2C19 3584/4885TSHR 4055/4885

“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.