SCHEMBL10194453

SCHEMBL10194453

O=C(NO)c1ccc(N2CCC(CNS(=O)(=O)c3ccc4ccccc4c3)CC2)nc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 10/20 0.56
▸ HDAC6 Q9UBN7 10/20 0.56
▸ HDAC3 O15379 9/20 0.56
▸ HDAC4 P56524 9/20 0.56
▸ HDAC7 Q8WUI4 9/20 0.56
▸ HDAC2 Q92769 9/20 0.56
▸ HDAC10 Q969S8 9/20 0.56
▸ HDAC11 Q96DB2 9/20 0.56
▸ HDAC8 Q9BY41 9/20 0.56
▸ HDAC9 Q9UKV0 9/20 0.56
▸ HDAC5 Q9UQL6 9/20 0.56
▸ F10 P00742 2/20 0.53
▸ BCHE P06276 2/20 0.52
▸ MAOB P27338 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ NPY5R Q15761 2/20 0.50
▸ TPSAB1 Q15661 1/20 0.49
▸ ACACB O00763 1/20 0.48

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
SCHEMBL10194570 0.91 F10 (0.55) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL8349036 0.89 HDAC6 (0.68) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL10194640 0.87 HDAC6 (0.60) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL10194493 0.86 F10 (0.51) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL10194627 0.86 HDAC8 (0.59) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL12933259 0.84 HDAC3 (0.51) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL10194572 0.83 F10 (0.45) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL10194599 0.83 HDAC6 (0.56) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL10194633 0.83 HDAC3 (0.60) HDAC1HDAC6HDAC3HDAC4HDAC7
SCHEMBL8222113 0.82 HDAC1 (0.77) HDAC1HDAC6HDAC3HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8513237-B2 Sulfonylamino-derivatives as novel inhibitors of histone deacetylase JANSSEN PHARMACEUTICA N.V. (BE) 2013-08-20 — — US disclosed
US-20120178741-A1 Sulfonylamino-Derivatives As Novel Inhibitors Of Histone Deacetylase JANSSEN PHARMACEUTICA N.V. (BE) 2012-07-12 — — US disclosed
US-8163733-B2 Sulfonylamino-derivatives as novel inhibitors of histone deacetylase JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-24 — — US disclosed
US-8163733-B2 Sulfonylamino-derivatives as novel inhibitors of histone deacetylase JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-24 — — US disclosed
US-7868205-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2011-01-11 — — US disclosed
US-7868205-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2011-01-11 — — US disclosed
US-20100234353-A1 SULFONYLAMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2010-09-16 — — US disclosed
US-20100234353-A1 SULFONYLAMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2010-09-16 — — US disclosed
US-7767679-B2 Sulfonylamino-derivatives as novel inhibitors of histone deacetylase JANSSEN PHARMACEUTICA N.V. (BE) 2010-08-03 — — US disclosed
US-7767679-B2 Sulfonylamino-derivatives as novel inhibitors of histone deacetylase JANSSEN PHARMACEUTICA N.V. (BE) 2010-08-03 — — US disclosed
US-20080132459-A1 Inhibitors of Histone Deacetylase METHYLGENE, INC. (CA) 2008-06-05 — — US disclosed
US-20080132459-A1 Inhibitors of Histone Deacetylase METHYLGENE, INC. (CA) 2008-06-05 — — 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 (3 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-20100234353-A1 SULFONYLAMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE HDAC1, HDAC3, HDAC11 HDAC1 1/4885HDAC6 11/4885HDAC3 2/4885
US-20080132459-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 HDAC1 1/4885HDAC6 6/4885HDAC3 3/4885
US-20120178741-A1 Sulfonylamino-Derivatives As Novel Inhibitors Of Histone Deacetylase HDAC1, HDAC3, HDAC11 HDAC1 1/4885HDAC6 11/4885HDAC3 2/4885

“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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