SCHEMBL21628630

SCHEMBL21628630

CC(C)c1ccc(Oc2ncc(C(=O)NO)cc2F)cc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 12/20 0.49
HDAC3 O15379 3/20 0.48
HDAC1 Q13547 3/20 0.48
HDAC2 Q92769 3/20 0.48
HDAC8 Q9BY41 1/20 0.48
PTGER4 P35408 7/20 0.46
PTGER2 P43116 2/20 0.46
SCN9A Q15858 1/20 0.41

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
SCHEMBL21628727 0.90 PTGER4 (0.46) HDAC6HDAC3HDAC1HDAC2HDAC8
SCHEMBL21628530 0.87 HDAC6 (0.52) HDAC6HDAC3HDAC1HDAC2HDAC8
SCHEMBL21628555 0.86 PTGER4 (0.44) PTGER4PTGER2SCN9A
SCHEMBL21628800 0.86 PTGER4 (0.51) PTGER4PTGER2
SCHEMBL21628825 0.86 HDAC6 (0.50) HDAC6HDAC3HDAC1HDAC2PTGER4
SCHEMBL21656943 0.86 HDAC6 (0.41) HDAC6HDAC3HDAC1HDAC2HDAC8
SCHEMBL29920978 0.85 ICAM1 (0.44) PTGER4PTGER2
SCHEMBL21628836 0.85 ICAM1 (0.44) PTGER4PTGER2
SCHEMBL21628870 0.83 PTGER4 (0.45) HDAC6HDAC3HDAC1HDAC2HDAC8
SCHEMBL21628740 0.83 HDAC6 (0.50) HDAC6HDAC3HDAC1HDAC2HDAC8

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 2604/4885HDAC3 1743/4885HDAC1 1840/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC3 1743/4885HDAC1 1840/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK HDAC6 2978/4885HDAC3 2037/4885HDAC1 2387/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC3 1743/4885HDAC1 1840/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR HDAC6 1293/4885HDAC3 102/4885HDAC1 315/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC3 1743/4885HDAC1 1840/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC3 1743/4885HDAC1 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.