SCHEMBL19277700

SCHEMBL19277700

CC(=O)C1=CCCC2(CCCC2)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 2/20 0.33
▸ HDAC2 Q92769 2/20 0.33
▸ HDAC8 Q9BY41 2/20 0.33
▸ HDAC6 Q9UBN7 2/20 0.33
▸ CTSK P43235 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33
▸ HDAC5 Q9UQL6 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
SCHEMBL19277945 0.81 — —
SCHEMBL3396592 0.80 CHRM3 (0.45) HDAC4HDAC2HDAC8HDAC6HDAC3
SCHEMBL3397960 0.79 CHRM3 (0.44) HDAC4HDAC2HDAC8HDAC6HDAC3
SCHEMBL7776196 0.73 — —
SCHEMBL7776198 0.73 — —
SCHEMBL758157 0.72 FAAH (0.31) —
SCHEMBL581196 0.72 — —
SCHEMBL7771926 0.71 FAAH (0.31) —
SCHEMBL720598 0.70 — —
SCHEMBL310711 0.69 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3416937-B1 PROCESS FOR PREPARING SPIROGALBANONE GIVAUDAN SA (CH) 2020-10-21 — — EP disclosed
US-10227280-B1 Process for preparing spirogalbanone Givaudan, S.A. (CH) 2019-03-12 — — US disclosed
US-20190055181-A1 Process For Preparing Spirogalbanone GIVAUDAN SA (CH) 2019-02-21 — — US disclosed
WO-2017140607-A1 PROCESS FOR PREPARING SPIROGALBANONE GIVAUDAN SA (CH) 2017-08-24 — — 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 (2 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-10227280-B1 Process for preparing spirogalbanone ADH1C, GALE, AKR1C3 HDAC4 1475/4885HDAC2 1021/4885HDAC8 1764/4885
US-20190055181-A1 Process For Preparing Spirogalbanone ADH1C, GALE, AKR1C3 HDAC4 1471/4885HDAC2 1015/4885HDAC8 1718/4885

“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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