SCHEMBL4336859

SCHEMBL4336859

O=C(CCCCCc1ncc(-c2ccccc2)o1)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 1.00
HDAC2 Q92769 12/20 1.00
HDAC6 Q9UBN7 10/20 1.00
HDAC8 Q9BY41 8/20 1.00
HDAC3 O15379 8/20 1.00
HDAC4 P56524 6/20 1.00
HDAC7 Q8WUI4 6/20 1.00
HDAC10 Q969S8 6/20 1.00
HDAC11 Q96DB2 6/20 1.00
HDAC9 Q9UKV0 6/20 1.00
HDAC5 Q9UQL6 6/20 1.00
RXRA P19793 1/20 0.60
RXRB P28702 1/20 0.60
RXRG P48443 1/20 0.60
FAAH O00519 1/20 0.55
CES1 P23141 1/20 0.55
ALOX5 P09917 1/20 0.54
NOTUM Q6P988 1/20 0.51

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
SCHEMBL4338759 0.89 HDAC1 (1.00) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL3045891 0.87 HDAC1 (0.76) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL4327548 0.87 HDAC1 (0.76) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL3054236 0.84 HDAC1 (0.72) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL15606558 0.82 HDAC1 (0.70) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL10247700 0.81 RXRA (0.78) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL4335149 0.79 HDAC1 (0.65) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL14624038 0.79 HDAC1 (0.65) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL10247702 0.78 HDAC1 (0.64) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL4329559 0.78 HDAC1 (0.77) HDAC1HDAC2HDAC6HDAC8HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070208065-A1 Hydroxamic Acid Derivative and Medicine Containing the Same as Active Ingredient SHIZUOKA COFFEIN CO., LTD. (JP) 2007-09-06 US claimed
EP-1787986-A1 HYDROXAMIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME AS ACTIVE INGREDIENT SHIZUOKA COFFEIN CO., LTD. (JP) 2007-05-23 EP claimed
US-7521563-B2 Hydroxamic acid derivative and medicine containing the same as active ingredient SHIZUOKA COFFEIN CO., LTD. (JP) 2009-04-21 US disclosed
US-20070208065-A1 Hydroxamic Acid Derivative and Medicine Containing the Same as Active Ingredient SHIZUOKA COFFEIN CO., LTD. (JP) 2007-09-06 US disclosed
EP-1787986-A1 HYDROXAMIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME AS ACTIVE INGREDIENT SHIZUOKA COFFEIN CO., LTD. (JP) 2007-05-23 EP 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-20070208065-A1 Hydroxamic Acid Derivative and Medicine Containing the Same as Active Ingredient IL6, IL1A, TNF HDAC1 27/4885HDAC2 69/4885HDAC6 87/4885

“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.