SCHEMBL7366339

SCHEMBL7366339

CNC(=O)C(=O)CCCCCCc1cnc(-c2ccc(Br)cc2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 19/20 1.00
HDAC2 Q92769 18/20 1.00
HDAC6 Q9UBN7 10/20 0.73
HDAC3 O15379 9/20 0.73
HDAC8 Q9BY41 9/20 0.73
HDAC4 P56524 8/20 0.73
HDAC7 Q8WUI4 8/20 0.73
HDAC10 Q969S8 8/20 0.73
HDAC11 Q96DB2 8/20 0.73
HDAC9 Q9UKV0 8/20 0.73
HDAC5 Q9UQL6 8/20 0.73

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
SCHEMBL7366829 0.88 HDAC1 (1.00) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL7368570 0.72 HDAC1 (0.72) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL7366770 0.70 HDAC1 (0.65) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL7371056 0.68 HDAC1 (1.00) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL4375512 0.67 HDAC1 (0.50) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL7368551 0.66 HDAC1 (0.60) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL4338759 0.63 HDAC1 (1.00) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL1567653 0.63 KDM4E (0.61) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL3501240 0.62 NPC1 (0.49) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL4329559 0.62 HDAC1 (0.77) HDAC1HDAC2HDAC6HDAC3HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020177594-A1 Inhibitors of histone deacetylase ABBOTT LABORATORIES 2002-11-28 US disclosed
WO-2002046129-A2 INHIBITORS OF HISTONE DEACETYLASE ABBOTT LABORATORIES (US) 2002-06-13 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-20020177594-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC2 4/4885HDAC6 7/4885

“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.