SCHEMBL3087563

SCHEMBL3087563

Nc1ccccc1NC(=O)C=Cc1ccc(C(Nc2ccc3ccccc3c2)C(=O)NC2CCCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.49
MEF2D Q14814 2/20 0.49
EP300 Q09472 1/20 0.49
HDAC1 Q13547 15/20 0.47
HDAC3 O15379 3/20 0.47
HDAC2 Q92769 2/20 0.47
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
HTR1E P28566 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
S1PR3 Q99500 1/20 0.44
HDAC8 Q9BY41 1/20 0.42
RARB P10826 1/20 0.42

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
SCHEMBL3087557 1.00 HDAC4 (0.49) HDAC4MEF2DEP300HDAC1HDAC3
SCHEMBL3095708 0.90 HDAC4 (0.54) HDAC4MEF2DEP300HDAC1HDAC3
SCHEMBL3095718 0.90 HDAC4 (0.54) HDAC4MEF2DEP300HDAC1HDAC3
SCHEMBL3099075 0.90 HDAC1 (0.51) HDAC4MEF2DEP300HDAC1HDAC3
SCHEMBL3099065 0.90 HDAC1 (0.51) HDAC4MEF2DEP300HDAC1HDAC3
SCHEMBL3098895 0.88 HDAC4 (0.54) HDAC4MEF2DEP300HDAC1HDAC3
SCHEMBL3098908 0.88 HDAC4 (0.54) HDAC4MEF2DEP300HDAC1HDAC3
SCHEMBL3094994 0.88 HDAC1 (0.56) HDAC4HDAC1HDAC3HDAC2MEN1
SCHEMBL3094984 0.88 HDAC1 (0.56) HDAC4HDAC1HDAC3HDAC2MEN1
SCHEMBL3104794 0.85 HDAC1 (0.48) HDAC4MEF2DHDAC1HDAC3HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2238103-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-10-13 EP disclosed
US-7795315-B2 N-(2-amino-phenyl)-amide derivatives HOFFMAN-LA ROCHE INC. (US) 2010-09-14 US disclosed
US-20090203681-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-08-13 US disclosed
WO-2009095324-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-08-06 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-20090203681-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES MKI67, API5, BAD HDAC4 1003/4885MEF2D 923/4885EP300 1121/4885

“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.