SCHEMBL916482

SCHEMBL916482

O=C(NO)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 14/20 1.00
HDAC7 Q8WUI4 4/20 1.00
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
HDAC6 Q9UBN7 10/20 0.62
HDAC2 Q92769 5/20 0.62
HDAC3 O15379 4/20 0.62
HDAC10 Q969S8 4/20 0.62
HDAC4 P56524 4/20 0.61
HDAC8 Q9BY41 3/20 0.61
HDAC9 Q9UKV0 3/20 0.61
HDAC5 Q9UQL6 3/20 0.61
HDAC11 Q96DB2 2/20 0.59
KCNH2 Q12809 1/20 0.57
HPGD P15428 1/20 0.56

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
SCHEMBL31424923 0.85 MEN1 (0.74) HDAC1HDAC7MEN1KMT2AHDAC6
SCHEMBL28462499 0.84 HDAC1 (0.72) HDAC1HDAC7HDAC6HDAC2HDAC3
SCHEMBL16039000 0.84 HDAC1 (0.72) HDAC1HDAC7MEN1KMT2AHDAC2
SCHEMBL1365105 0.83 HDAC1 (0.70) HDAC1HDAC7HDAC6HDAC2HDAC3
SCHEMBL8221904 0.82 HDAC1 (0.70) HDAC1HDAC7MEN1KMT2AHDAC6
SCHEMBL16038134 0.82 HDAC1 (0.69) HDAC1HDAC7MEN1KMT2AHPGD
SCHEMBL31753078 0.82 KMT2A (0.74) HDAC1HDAC7MEN1KMT2AHPGD
SCHEMBL916927 0.82 KMT2A (0.74) HDAC1HDAC7MEN1KMT2AHPGD
SCHEMBL1364992 0.82 HDAC1 (0.68) HDAC1HDAC7HDAC6HDAC2HDAC3
SCHEMBL18537332 0.81 HDAC1 (0.71) HDAC1HDAC7MEN1KMT2AHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110003878-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS UNIVERSIDAD DE GRANADA (ES) 2011-01-06 US claimed
EP-2045239-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS Universidad De Granada (ES) 2009-04-08 EP claimed
US-20110003878-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS UNIVERSIDAD DE GRANADA (ES) 2011-01-06 US disclosed
US-20110003878-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS UNIVERSIDAD DE GRANADA (ES) 2011-01-06 US disclosed
US-20110003878-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS UNIVERSIDAD DE GRANADA (ES) 2011-01-06 US disclosed
EP-2045239-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS Universidad De Granada (ES) 2009-04-08 EP disclosed
WO-2008003801-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS UNIVERSIDAD DE GRANADA (ES) 2008-01-10 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-20110003878-A1 NOVEL DERIVATIVES OF PHTHALIMIDE AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC2, HDAC11 HDAC1 1/4885HDAC7 10/4885MEN1 2731/4885

“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.