SCHEMBL9294229

SCHEMBL9294229

COC(=O)c1c(O)cccc1/C=C/c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.61
CA1 P00915 2/20 0.61
CA2 P00918 2/20 0.61
CA7 P43166 2/20 0.61
CA9 Q16790 2/20 0.61
CA14 Q9ULX7 2/20 0.61
TRPA1 O75762 2/20 0.54
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
RELA Q04206 1/20 0.47
NFE2L2 Q16236 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
KDM4E B2RXH2 2/20 0.46
SNCA P37840 2/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL9294233 1.00 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL9639720 0.85 HSD17B10 (0.52) CA12CA1CA2CA7CA9
SCHEMBL9294987 0.84 CA12 (0.64) CA12CA1CA2CA7CA9
SCHEMBL9294982 0.84 CA12 (0.64) CA12CA1CA2CA7CA9
SCHEMBL5960451 0.83 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL5960447 0.83 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL26744668 0.83 TRPA1 (0.59) CA12CA1CA2CA7CA9
SCHEMBL1647970 0.82 TRPA1 (0.63) CA12CA1CA2CA7CA9
SCHEMBL21530613 0.82 TRPA1 (0.63) CA12CA1CA2CA7CA9
SCHEMBL30477514 0.82 TRPA1 (0.63) CA12CA1CA2CA7CA9

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230355557-A1 ANTIVIRAL SOX INHIBITORS GERTRUDE BIOMEDICAL PTY LTD (AU) 2023-11-09 US disclosed
US-20230355557-A1 ANTIVIRAL SOX INHIBITORS GERTRUDE BIOMEDICAL PTY LTD (AU) 2023-11-09 US disclosed
US-20230355557-A1 ANTIVIRAL SOX INHIBITORS GERTRUDE BIOMEDICAL PTY LTD (AU) 2023-11-09 US disclosed
WO-2022040719-A1 ANTIVIRAL SOX INHIBITORS GERTRUDE BIOMEDICAL PTY LTD (AU) 2022-03-03 WO disclosed
US-5371062-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1994-12-06 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-20230355557-A1 ANTIVIRAL SOX INHIBITORS SOX18, IRF3, YBX1 CA12 3381/4885CA1 3889/4885CA2 3290/4885

“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.