SCHEMBL17355793

SCHEMBL17355793

COC(=O)C(=O)Oc1ccc(F)cc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 1/20 0.44
▸ NOTUM Q6P988 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ RBP4 P02753 1/20 0.38
▸ TTR P02766 1/20 0.38
▸ IDO1 P14902 2/20 0.37
▸ SMO Q99835 1/20 0.37
▸ P2RY1 P47900 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ NR3C2 P08235 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ SCN8A Q9UQD0 1/20 0.36
▸ SCN10A Q9Y5Y9 1/20 0.36

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
SCHEMBL17355817 0.92 MRGPRX4 (0.49) MRGPRX4RBP4TTRIDO1P2RY1
SCHEMBL17355790 0.88 NOTUM (0.41) MRGPRX4NOTUMEPHX2RBP4TTR
SCHEMBL17355763 0.86 MRGPRX4 (0.45) MRGPRX4NOTUMEPHX2RBP4TTR
SCHEMBL17355657 0.86 MRGPRX4 (0.45) MRGPRX4RBP4TTRIDO1P2RY1
SCHEMBL17355803 0.83 MRGPRX4 (0.51) MRGPRX4RBP4CYP1A2CYP2C19
SCHEMBL3325352 0.82 MRGPRX4 (0.47) MRGPRX4RBP4TTRIDO1CYP2C19
SCHEMBL18697296 0.80 MRGPRX4 (0.48) MRGPRX4RBP4TTRIDO1SMO
SCHEMBL17356494 0.78 HTR1D (0.40) EPHX2
SCHEMBL17355824 0.78 MRGPRX4 (0.46) MRGPRX4RBP4TTRIDO1
SCHEMBL17355820 0.78 MRGPRX4 (0.49) MRGPRX4EPHX2RBP4TTRIDO1

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 MRGPRX4 4355/4885NOTUM 723/4885EPHX2 403/4885

“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.

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