SCHEMBL21628751

SCHEMBL21628751

CCC(CC)c1ccc(Oc2ccc(C(=O)NO)cc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 8/20 0.81
HDAC8 Q9BY41 7/20 0.81
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
HDAC1 Q13547 6/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALOX15 P16050 1/20 0.49
GFER P55789 1/20 0.49
ADAM17 P78536 1/20 0.49
MMP1 P03956 3/20 0.46
MMP2 P08253 2/20 0.45
MMP9 P14780 2/20 0.45
MMP12 P39900 2/20 0.45
MMP13 P45452 2/20 0.45
HDAC2 Q92769 4/20 0.45
HDAC3 O15379 3/20 0.45
HDAC4 P56524 3/20 0.45

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
SCHEMBL21628792 0.88 HPGD (0.69) HDAC6HDAC8HPGDTSHRHTT
SCHEMBL21628402 0.84 HDAC6 (0.61) HDAC6HDAC8HDAC1HDAC2HDAC3
SCHEMBL21628816 0.83 HDAC6 (0.59) HDAC6HDAC8HDAC1
SCHEMBL21656844 0.83 HDAC8 (0.54) HDAC6HDAC8CA1CA2HPGD
SCHEMBL21656832 0.82 SRD5A2 (0.58) HDAC6HDAC8CA1CA2HPGD
SCHEMBL21628436 0.82 HDAC6 (0.59) HDAC6HDAC8CA1CA2HDAC1
SCHEMBL21628742 0.81 PARP10 (0.63) HDAC6HDAC8CA1CA2HPGD
SCHEMBL21628685 0.79 PLK1 (0.58) HDAC6HDAC8CA1CA2HDAC1
SCHEMBL24293854 0.78 HDAC8 (0.49) HDAC6HDAC8HPGDHTTALOX15
SCHEMBL21656852 0.78 CA12 (0.53) HDAC6HDAC8CA1CA2HPGD

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 768/4885CA1 4881/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885CA1 4881/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK HDAC6 2978/4885HDAC8 883/4885CA1 4882/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885CA1 4881/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR HDAC6 1293/4885HDAC8 699/4885CA1 3602/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885CA1 4881/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK HDAC6 2604/4885HDAC8 768/4885CA1 4881/4885

“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.