SCHEMBL21628663

SCHEMBL21628663

O=C(NO)c1cnc(Oc2ccc(C3CCCCCC3)cc2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.51
HDAC8 Q9BY41 3/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC3 O15379 3/20 0.47
HDAC11 Q96DB2 2/20 0.47
HDAC2 Q92769 1/20 0.41
NAMPT P43490 1/20 0.41
DEGS1 O15121 1/20 0.41
STAT3 P40763 4/20 0.40
HAO1 Q9UJM8 1/20 0.39
CNR1 P21554 1/20 0.38
ABL1 P00519 1/20 0.38
HPGDS O60760 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR35 Q9HC97 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
SCHEMBL20482263 1.00 HDAC6 (0.51) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628739 0.99 HDAC6 (0.52) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628664 0.97 HDAC6 (0.49) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628554 0.94 HDAC6 (0.45) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL21628784 0.90 SCN9A (0.45) HDAC6HDAC8HDAC1NAMPTDEGS1
SCHEMBL21628435 0.90 SCN9A (0.45) HDAC6HDAC8HDAC1NAMPTDEGS1
SCHEMBL21628704 0.89 SCN9A (0.45) HDAC6HDAC8HDAC1NAMPTDEGS1
SCHEMBL20482060 0.87 KMT2A (0.45) NAMPTDEGS1STAT3HAO1MEN1
SCHEMBL21628889 0.87 KMT2A (0.45) NAMPTDEGS1STAT3HAO1MEN1
SCHEMBL21628418 0.86 PARP10 (0.45) HAO1KMT2A

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.