SCHEMBL23433185

SCHEMBL23433185

CC1CCCC(c2cccc(=O)c(O)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.53
▸ HDAC2 Q92769 1/20 0.53
▸ HDAC8 Q9BY41 1/20 0.53
▸ KMO O15229 1/20 0.38
▸ ACMSD Q8TDX5 2/20 0.35
▸ SIGMAR1 Q99720 3/20 0.35
▸ DRD4 P21917 2/20 0.35
▸ DRD3 P35462 2/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ PRCP P42785 1/20 0.35
▸ EBP Q15125 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ RAB9A P51151 1/20 0.34
▸ MGLL Q99685 1/20 0.33

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 0.82 HDAC4 (0.74) HDAC4HDAC2HDAC8KMOACMSD
SCHEMBL21471547 0.81 HDAC4 (0.72) HDAC4HDAC2HDAC8KMOACMSD
SCHEMBL21568453 0.76 HTR2C (0.53) HDAC4HDAC2HDAC8KMODRD4
SCHEMBL11424101 0.75 GRIA4 (0.41) HDAC4HDAC2HDAC8DRD4
SCHEMBL23250721 0.74 HDAC4 (0.49) HDAC4HDAC2HDAC8KMO
SCHEMBL27973302 0.74 ACMSD (0.41) HDAC4HDAC2HDAC8ACMSD
SCHEMBL2493273 0.73 TRPA1 (0.44) —
SCHEMBL23250778 0.73 HDAC4 (0.47) HDAC4HDAC2HDAC8KMOMGLL
SCHEMBL9769937 0.72 ACMSD (0.70) KMOACMSD
SCHEMBL23258566 0.72 QDPR (0.62) HDAC4HDAC2HDAC8KMOSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210163393-A1 HINOKITIOL ANALOGUES, METHODS OF PREPARING AND PHARMACEUTICAL COMPOSITIONS THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2021-06-03 — — 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-20210163393-A1 HINOKITIOL ANALOGUES, METHODS OF PREPARING AND PHARMACEUTICAL COMPOSITIONS THEREOF CYP27A1, CYP27B1, HSD17B7 HDAC4 1472/4885HDAC2 766/4885HDAC8 1482/4885

“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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