SCHEMBL24429360

SCHEMBL24429360

O=C(NO)c1cc(CSN2c3ccccc3CCc3ccccc32)on1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 12/20 0.48
RIPK1 Q13546 5/20 0.43
HDAC1 Q13547 8/20 0.42
HDAC3 O15379 3/20 0.42
HDAC2 Q92769 3/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL27295996 0.70 HDAC6 (0.52) HDAC6RIPK1HDAC3ALDH1A1HPGD
SCHEMBL5452480 0.69 HDAC6 (0.50) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL5447769 0.68 HDAC6 (0.50) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL5451508 0.67 HDAC6 (0.47) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL5454441 0.66 HDAC6 (0.46) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL5453454 0.66 SMN1; SMN2 (0.48) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL5458916 0.66 HDAC6 (0.46) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL5453519 0.65 MEN1 (0.54) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL5448449 0.65 THRB (0.48) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL20524111 0.65 HDAC6 (1.00) HDAC6HDAC1HDAC3HDAC2HDAC10

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-12024493-B2 Isoxazole hydroxamic acids as histone deacetylase 6 inhibitors THE GEORGE WASHINGTON UNIVERSITY, A CONGRESSIONALLY CHARTERED NOT-FOR-PROFIT CORPORATION (US) 2024-07-02 US disclosed
US-20220153709-A1 ISOXAZOLE HYDROXAMIC ACIDS AS HISTONE DEACETYLASE 6 INHIBITORS THE GEORGE WASHINGTON UNIVERSITY, A CONGRESSIONALLY CHARTERED NOT-FOR-PROFIT CORPORATION (US) 2022-05-19 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 (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-20220153709-A1 ISOXAZOLE HYDROXAMIC ACIDS AS HISTONE DEACETYLASE 6 INHIBITORS HDAC1, HDAC7, HDAC5 HDAC6 10/4885RIPK1 3859/4885HDAC1 1/4885
US-12024493-B2 Isoxazole hydroxamic acids as histone deacetylase 6 inhibitors HDAC1, HDAC7, HDAC5 HDAC6 10/4885RIPK1 3859/4885HDAC1 1/4885

“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.