SCHEMBL3094153

SCHEMBL3094153

Nc1ccccc1NC(=O)C=Cc1ccc(C(Nc2cccnc2)C(=O)NCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 0.58
HDAC4 P56524 3/20 0.52
MEF2D Q14814 3/20 0.52
HDAC3 O15379 2/20 0.49
HDAC6 Q9UBN7 1/20 0.49
EP300 Q09472 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
NAMPT P43490 1/20 0.48
POLB P06746 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
SCHEMBL3094135 1.00 HDAC1 (0.58) HDAC1HDAC4MEF2DHDAC3HDAC6
SCHEMBL3098392 0.91 HDAC1 (0.64) HDAC1HDAC4MEF2DHDAC3HDAC6
SCHEMBL3098407 0.91 HDAC1 (0.64) HDAC1HDAC4MEF2DHDAC3HDAC6
SCHEMBL3091462 0.84 HDAC4 (0.64) HDAC1HDAC4MEF2DHDAC3HDAC6
SCHEMBL3091453 0.84 HDAC4 (0.64) HDAC1HDAC4MEF2DHDAC3HDAC6
SCHEMBL3095363 0.84 HDAC4 (0.60) HDAC1HDAC4MEF2DHDAC3EP300
SCHEMBL3095378 0.84 HDAC4 (0.60) HDAC1HDAC4MEF2DHDAC3EP300
SCHEMBL3099825 0.84 HDAC1 (0.61) HDAC1HDAC4MEF2DHDAC3EP300
SCHEMBL3099815 0.84 HDAC1 (0.61) HDAC1HDAC4MEF2DHDAC3EP300
SCHEMBL3095602 0.83 HDAC1 (0.67) HDAC1HDAC4MEF2DHDAC3HDAC6

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 HDAC1 815/4885HDAC4 1003/4885MEF2D 923/4885

“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.