SCHEMBL21628899

SCHEMBL21628899

O=C(NO)c1ccc(Oc2ccc(C3CCCCCC3)cc2)nc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.59
HDAC8 Q9BY41 3/20 0.59
HDAC1 Q13547 2/20 0.59
HDAC3 O15379 3/20 0.54
HDAC11 Q96DB2 2/20 0.54
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HAO1 Q9UJM8 1/20 0.48
DEGS1 O15121 1/20 0.46
HRH3 Q9Y5N1 3/20 0.46
HDAC2 Q92769 1/20 0.44
NAMPT P43490 1/20 0.44

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
SCHEMBL20482486 1.00 HDAC6 (0.59) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628913 0.99 HDAC8 (0.61) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628427 0.96 HDAC8 (0.57) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628712 0.94 HDAC6 (0.52) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628400 0.89 HRH3 (0.58) HDAC6HDAC8HDAC1POLBSMN1; SMN2
SCHEMBL21628822 0.89 HRH3 (0.58) HDAC6HDAC8HDAC1POLBSMN1; SMN2
SCHEMBL21656867 0.88 HRH3 (0.59) HDAC6HDAC8HDAC1POLBSMN1; SMN2
SCHEMBL29265289 0.86 POLB (0.46) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21656971 0.86 HAO1 (0.51) POLBSMN1; SMN2HAO1DEGS1HRH3
SCHEMBL19362956 0.86 HAO1 (0.51) POLBSMN1; SMN2HAO1DEGS1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12600696-B2 Aromatic compounds Xeniopro GmbH (DE) 2026-04-14 US disclosed
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-05-18 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2022-11-03 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 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 (7 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-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885HDAC1 1840/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885HDAC1 1840/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK HDAC6 2978/4885HDAC8 883/4885HDAC1 2387/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885HDAC1 1840/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR HDAC6 1293/4885HDAC8 699/4885HDAC1 315/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885HDAC1 1840/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885HDAC1 1840/4885

“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.