SCHEMBL3381443

SCHEMBL3381443

O=C(O)CCCCCCOc1ccc(-c2ccccc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 12/20 0.77
▸ HDAC4 P56524 12/20 0.77
▸ HDAC1 Q13547 12/20 0.77
▸ HDAC7 Q8WUI4 12/20 0.77
▸ HDAC2 Q92769 12/20 0.77
▸ HDAC10 Q969S8 12/20 0.77
▸ HDAC11 Q96DB2 12/20 0.77
▸ HDAC8 Q9BY41 12/20 0.77
▸ HDAC6 Q9UBN7 12/20 0.77
▸ HDAC9 Q9UKV0 12/20 0.77
▸ HDAC5 Q9UQL6 12/20 0.77
▸ PPARA Q07869 3/20 0.69
▸ FFAR4 Q5NUL3 2/20 0.67
▸ FFAR1 O14842 2/20 0.67
▸ LTA4H P09960 1/20 0.59
▸ MMP3 P08254 1/20 0.59

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
SCHEMBL1007408 1.00 HDAC3 (0.77) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7515225 1.00 HDAC3 (0.77) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7049246 0.93 FFAR4 (0.75) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL503552 0.89 PPARA (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL557510 0.89 PPARA (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL25228768 0.89 PPARA (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11790866 0.89 PPARA (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1008297 0.89 PPARA (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11616532 0.89 PPARA (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL712775 0.89 PPARA (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1280764-B1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC (CA) 2010-11-24 — — EP disclosed
US-20090181971-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. 2009-07-16 — — US disclosed
US-20090181971-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. 2009-07-16 — — US disclosed
US-20090181971-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. 2009-07-16 — — US disclosed
US-20090130344-A1 COMPOSITION, FILM AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPORATION (JP) 2009-05-21 — — US disclosed
US-20090130344-A1 COMPOSITION, FILM AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPORATION (JP) 2009-05-21 — — US disclosed
US-7288567-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2007-10-30 — — US disclosed
US-7288567-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2007-10-30 — — US disclosed
US-7288567-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2007-10-30 — — US disclosed
EP-1524262-A1 Inhibitors of histone deacetylase Methylgene, Inc. (CA) 2005-04-20 — — EP disclosed
EP-1280764-A2 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2003-02-05 — — EP disclosed
US-20020177594-A1 Inhibitors of histone deacetylase ABBOTT LABORATORIES 2002-11-28 — — US disclosed
US-20020115826-A1 Inhibitors of histone deacetylase 92229129 QUEBEC INC. (CA) 2002-08-22 — — US disclosed
US-20020103192-A1 Inhibitors of histone deacetylase ABBOTT LABORATORIES 2002-08-01 — — US disclosed
WO-2002046129-A2 INHIBITORS OF HISTONE DEACETYLASE ABBOTT LABORATORIES (US) 2002-06-13 — — WO disclosed
WO-2001070675-A2 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2001-09-27 — — WO disclosed
US-5066658-A Enzyme Inhibitors; Bronchodilators; Antiinflammatory Agents ORTHO PHARMACEUTICAL CORPORATION (US) 1991-11-19 — — 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 (4 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-20020103192-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC4 HDAC3 6/4885HDAC4 3/4885HDAC1 1/4885
US-20020177594-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC3 HDAC3 3/4885HDAC4 10/4885HDAC1 1/4885
US-20020115826-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 HDAC3 3/4885HDAC4 8/4885HDAC1 1/4885
US-20090181971-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 HDAC3 3/4885HDAC4 8/4885HDAC1 1/4885

“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.

Send feedback