SCHEMBL4415910

SCHEMBL4415910

CCCCCNNC(=O)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 17/20 0.76
HDAC1 Q13547 13/20 0.76
HDAC2 Q92769 13/20 0.76
HDAC8 Q9BY41 4/20 0.74
NCOR2 Q9Y618 3/20 0.74
NAAA Q02083 1/20 0.68
HDAC11 Q96DB2 3/20 0.66
HDAC6 Q9UBN7 2/20 0.64
HDAC10 Q969S8 1/20 0.64

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
SCHEMBL6640133 0.98 HDAC3 (0.77) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL6636519 0.95 HDAC3 (0.82) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL17141819 0.91 HDAC3 (0.91) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL8423787 0.87 HDAC3 (0.79) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL21435718 0.87 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL21435742 0.86 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL21435717 0.86 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL21435734 0.86 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL21435731 0.86 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL28970457 0.86 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116535357-A Arylamino benzamide derivative containing substituted pyrazole structure, preparation method and application 西北农林科技大学 2023-08-04 CN claimed
CN-116535357-A Arylamino benzamide derivative containing substituted pyrazole structure, preparation method and application 西北农林科技大学 2023-08-04 CN disclosed
CN-116535357-A Arylamino benzamide derivative containing substituted pyrazole structure, preparation method and application 西北农林科技大学 2023-08-04 CN disclosed
CN-116535357-A Arylamino benzamide derivative containing substituted pyrazole structure, preparation method and application 西北农林科技大学 2023-08-04 CN disclosed
US-20110065734-A1 NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES 4SC AG (DE) 2011-03-17 US disclosed
EP-2060565-A1 Novel bifunctional compounds which inhibit protein kinases and histone deacetylases 4SC AG (DE) 2009-05-20 EP disclosed
US-5955506-A ACETAMIDOBENZAMIDE COMPOUNDS FOR TREATMENT OF PARKINSON'S DISEASE CENTAUR PHARMACEUTICALS, INC. (US) 1999-09-21 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 (1 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-20110065734-A1 NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES HDAC1, HDAC11, MAP2K2 HDAC3 18/4885HDAC1 1/4885HDAC2 4/4885

“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.