SCHEMBL23565946

SCHEMBL23565946

COC(=O)c1ccc2c(c1)C[C@@]1(CCN(C(=O)OC(C)(C)C)C1)C2

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.45
▸ SCD5 Q86SK9 1/20 0.45
▸ HDAC2 Q92769 2/20 0.44
▸ CYP11B2 P19099 1/20 0.44
▸ ACACB O00763 5/20 0.43
▸ HDAC1 Q13547 2/20 0.42
▸ GPR183 P32249 1/20 0.41
▸ NR1H2 P55055 2/20 0.41
▸ GPR119 Q8TDV5 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ USP30 Q70CQ3 1/20 0.39
▸ NAMPT P43490 2/20 0.39

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
SCHEMBL21084116 1.00 PKM (0.45) PKMSCD5HDAC2CYP11B2ACACB
SCHEMBL21124030 1.00 PKM (0.45) PKMSCD5HDAC2CYP11B2ACACB
SCHEMBL21124029 0.85 CYP2D6 (0.44) —
SCHEMBL23887653 0.83 NR1H2 (0.58) SCD5HDAC2CYP11B2ACACBHDAC1
SCHEMBL22837373 0.80 CYP3A4 (0.44) —
SCHEMBL23565948 0.80 CYP3A4 (0.44) —
SCHEMBL19718188 0.80 CYP3A4 (0.44) —
SCHEMBL23051642 0.80 SCD5 (0.47) SCD5HDAC2CYP11B2ACACBHDAC1
SCHEMBL23887675 0.79 ALDH1A1 (0.51) SCD5HDAC2CYP11B2ACACBHDAC1
SCHEMBL23051645 0.79 SCD5 (0.49) SCD5HDAC2CYP11B2ACACBHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12213969-B2 2-spiro-5- and 6-hydroxamic acid indanes as HDAC inhibitors VALO HEALTH, INC. (US) 2025-02-04 — — US disclosed
US-20230414585-A1 2-SPIRO-5- AND 6-HYDROXAMIC ACID INDANES AS HDAC INHIBITORS VALO EARLY DISCOVERY, INC. 2023-12-28 — — US disclosed
US-11730721-B2 2-spiro-5- and 6-hydroxamic acid indanes as HDAC inhibitors VALO HEALTH, INC. (US) 2023-08-22 — — US disclosed
US-11730721-B2 2-spiro-5- and 6-hydroxamic acid indanes as HDAC inhibitors VALO HEALTH, INC. (US) 2023-08-22 — — US disclosed
US-11730721-B2 2-spiro-5- and 6-hydroxamic acid indanes as HDAC inhibitors VALO HEALTH, INC. (US) 2023-08-22 — — US disclosed
US-20210186940-A1 2-SPIRO-5- AND 6-HYDROXAMIC ACID INDANES AS HDAC INHIBITORS VALO HEALTH, INC. 2021-06-24 — — 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 (4 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-20230414585-A1 2-SPIRO-5- AND 6-HYDROXAMIC ACID INDANES AS HDAC INHIBITORS HDAC5, HDAC2, HDAC1 PKM 2050/4885SCD5 714/4885HDAC2 2/4885
US-20210186940-A1 2-SPIRO-5- AND 6-HYDROXAMIC ACID INDANES AS HDAC INHIBITORS HDAC5, HDAC2, HDAC1 PKM 2050/4885SCD5 714/4885HDAC2 2/4885
US-12213969-B2 2-spiro-5- and 6-hydroxamic acid indanes as HDAC inhibitors HDAC5, HDAC2, HDAC1 PKM 2050/4885SCD5 714/4885HDAC2 2/4885
US-11730721-B2 2-spiro-5- and 6-hydroxamic acid indanes as HDAC inhibitors HDAC5, HDAC2, HDAC1 PKM 2050/4885SCD5 714/4885HDAC2 2/4885

“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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