SCHEMBL23258680

SCHEMBL23258680

O=c1cccc(C2CCOCC2)cc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.54
▸ HDAC2 Q92769 1/20 0.54
▸ HDAC8 Q9BY41 1/20 0.54
▸ OPRL1 P41146 1/20 0.43
▸ DAO P14920 1/20 0.40
▸ KMO O15229 1/20 0.38
▸ QDPR P09417 3/20 0.38
▸ CYP11B1 P15538 1/20 0.37
▸ CYP11B2 P19099 1/20 0.37
▸ DHFR P00374 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ ASAH1 Q13510 1/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ KDM1A O60341 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ DBH P09172 1/20 0.35
▸ ACMSD Q8TDX5 2/20 0.35
▸ IKBKE Q14164 1/20 0.34

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
SCHEMBL21471548 0.84 HDAC4 (0.74) HDAC4HDAC2HDAC8KMOQDPR
SCHEMBL21471547 0.83 HDAC4 (0.72) HDAC4HDAC2HDAC8KMOQDPR
SCHEMBL23258566 0.80 QDPR (0.62) HDAC4HDAC2HDAC8KMOQDPR
SCHEMBL7809070 0.79 OPRL1 (0.61) OPRL1PIK3CDPIK3CA
SCHEMBL23250752 0.79 HDAC4 (0.53) HDAC4HDAC2HDAC8KMOQDPR
SCHEMBL23250778 0.78 HDAC4 (0.47) HDAC4HDAC2HDAC8KMOQDPR
SCHEMBL23250724 0.77 ESR2 (0.43) HDAC4HDAC2HDAC8DAOQDPR
SCHEMBL27304482 0.77 HDAC4 (0.44) HDAC4HDAC2HDAC8QDPRKDM4E
SCHEMBL23250721 0.76 HDAC4 (0.49) HDAC4HDAC2HDAC8KMOQDPR
SCHEMBL23258881 0.74 HDAC4 (0.44) HDAC4HDAC2HDAC8KDM4E

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-20230406803-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS Kinesid Therapeutics, Inc (US) 2023-12-21 — — US disclosed
WO-2021076938-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS Ambys Medicines, Inc. (US) 2021-04-22 — — 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-20230406803-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS TXNRD2, TFRC, SDHB HDAC4 2346/4885HDAC2 2245/4885HDAC8 2696/4885

“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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