SCHEMBL14477632

SCHEMBL14477632

OBOc1ccc(OBO)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 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
SCHEMBL79980 0.88 ESR2 (0.52) MEN1KMT2AESR1ESR2CA12
SCHEMBL2602434 0.86 ACHE (0.48) MEN1KMT2ACA1CA2CA9
SCHEMBL18670944 0.86 NFE2L2 (0.37) CA1CA2CA7CA9
SCHEMBL626870 0.86 LMNA (0.42) MEN1KMT2ACA1CA2CA9
SCHEMBL819491 0.86 CYP2A6 (0.42) MEN1KMT2ACA1CA2CA9
SCHEMBL819814 0.86 CA1 (0.58) ESR2CA12CA1CA2CA7
SCHEMBL5148477 0.86 ALDH1A1 (0.50) MEN1KMT2ACA14
SCHEMBL121643 0.86 NFE2L2 (0.37) CA1CA2CA7CA9
SCHEMBL103797 0.84
SCHEMBL7129361 0.82 LTA4H (0.43) CA1CA2

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-9466839-B2 Electrode active material for electricity storage device, and electricity storage device using same PANASONIC CORPORATION (JP) 2016-10-11 US disclosed
US-20130004836-A1 ELECTRODE ACTIVE MATERIAL FOR ELECTRICITY STORAGE DEVICE, AND ELECTRICITY STORAGE DEVICE USING SAME PANASONIC CORPORATION (JP) 2013-01-03 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-20130004836-A1 ELECTRODE ACTIVE MATERIAL FOR ELECTRICITY STORAGE DEVICE, AND ELECTRICITY STORAGE DEVICE USING SAME HVCN1, H1-0, H1-2 MEN1 553/4885KMT2A 393/4885ESR1 53/4885

“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.