SCHEMBL8285508

SCHEMBL8285508

O=C(CCCCCCN(CCc1ccccc1)Cc1ccccc1)NO

nearest known ligand 0.84

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 17/20 0.84
▸ HDAC2 Q92769 12/20 0.84
▸ HDAC8 Q9BY41 10/20 0.84
▸ HDAC3 O15379 8/20 0.84
▸ NCOR2 Q9Y618 4/20 0.84
▸ ALOX5 P09917 1/20 0.66
▸ HDAC6 Q9UBN7 4/20 0.60
▸ HDAC5 Q9UQL6 1/20 0.60
▸ HDAC10 Q969S8 2/20 0.59
▸ HDAC11 Q96DB2 2/20 0.59
▸ HDAC4 P56524 1/20 0.54
▸ HDAC9 Q9UKV0 1/20 0.54

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
SCHEMBL22483752 0.94 HDAC1 (0.76) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL13965309 0.91 HDAC1 (1.00) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL1007344 0.85 MAPT (0.62) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL20952239 0.85 HDAC1 (0.91) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL13965297 0.82 HDAC1 (0.71) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL1007825 0.82 HDAC1 (0.57) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL8285512 0.82 HDAC1 (0.71) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL13783993 0.81 HDAC1 (0.93) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL13965291 0.81 HDAC1 (0.69) HDAC1HDAC2HDAC8HDAC3NCOR2
SCHEMBL5807174 0.80 HDAC1 (1.00) HDAC1HDAC2HDAC8HDAC3NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090023718-A1 Diamine and Iminodiacetic Acid Hydroxamic Acid Derivatives ATON PHARMA, INC. (US) 2009-01-22 — — US disclosed
US-20090023718-A1 Diamine and Iminodiacetic Acid Hydroxamic Acid Derivatives ATON PHARMA, INC. (US) 2009-01-22 — — US disclosed
WO-2005053610-A2 DIAMINE AND IMINODIACETIC ACID HYDROXAMIC ACID DERIVATIVES ATON PHARMA, INC. (US) 2005-06-16 — — WO 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-20090023718-A1 Diamine and Iminodiacetic Acid Hydroxamic Acid Derivatives AADAC, BRDT, HDAC5 HDAC1 5/4885HDAC2 7/4885HDAC8 36/4885

“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.

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