SCHEMBL5229928

SCHEMBL5229928

CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1cnc(S(C)(=O)=O)nc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.43
HDAC1 Q13547 3/20 0.43
METAP1 P53582 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
AHR P35869 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
MDM4 O15151 1/20 0.39
TP53 P04637 1/20 0.39
MDM2 Q00987 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
F10 P00742 1/20 0.39
BRD9 Q9H8M2 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
ALDH1A1 P00352 1/20 0.38

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
Methane SCHEMBL27601733 0.82 MDM4 (0.46) NAMPTHDAC1METAP1MEN1KMT2A
SCHEMBL5224578 0.81 KDM4E (0.44) NAMPTHDAC1METAP1MEN1KMT2A
SCHEMBL5228223 0.80 MDM4 (0.62) NAMPTHDAC1MEN1KMT2AAHR
SCHEMBL2831485 0.80 NAMPT (0.41) NAMPTHDAC1METAP1CA1CA2
SCHEMBL5225778 0.79 MEN1 (0.47) NAMPTHDAC1METAP1MEN1KMT2A
SCHEMBL2829176 0.79 POLB (0.56) NAMPTHDAC1MEN1KMT2ARXFP1
SCHEMBL22874499 0.78 P4HTM (0.65) MEN1KMT2AAHRP4HTMALDH1A1
SCHEMBL8566108 0.78 HPGD (0.60) MEN1KMT2ATP53ALDH1A1
SCHEMBL24890664 0.77 HDAC1 (0.53) NAMPTHDAC1MEN1KMT2AAHR
SCHEMBL14885229 0.77 MEN1 (0.57) NAMPTHDAC1METAP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501508-B1 INHIBITORS OF HISTONE DEACETYLASE ASTRAZENECA AB (SE) 2007-02-21 EP disclosed
US-20050222410-A1 Inhibitors of histone deacetylase ASTRAZENECA AB (SE) 2005-10-06 US disclosed
CN-1662236-A Inhibitors of histone deacetylase ASTRAZENECA AB (SE) 2005-08-31 CN disclosed
EP-1501508-A1 INHIBITORS OF HISTONE DEACETYLASE Astrazeneca AB (SE) 2005-02-02 EP disclosed
WO-2003092686-A1 INHIBITORS OF HISTONE DEACETYLASE ASTRAZENECA AB (SE) 2003-11-13 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-20050222410-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 NAMPT 776/4885HDAC1 1/4885METAP1 1553/4885

“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.