SCHEMBL5223801

SCHEMBL5223801

CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(N2CCCC2)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
TSHR P16473 1/20 0.45
HDAC3 O15379 1/20 0.44
HDAC2 Q92769 1/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 5/20 0.42
MEN1 O00255 3/20 0.42
GAA P10253 6/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL5225270 0.99 NPSR1 (0.46) MAPTNPSR1LMNAMAPK1TSHR
SCHEMBL5226822 0.89 MAPK8 (0.46) HDAC3HDAC2
SCHEMBL27601734 0.89 HDAC3 (0.43) MAPTNPSR1LMNAHDAC3HDAC2
SCHEMBL5226816 0.82 HDAC3 (0.38) MAPTNPSR1LMNATSHRHDAC3
SCHEMBL20163022 0.80 HDAC2 (0.52) MAPTHDAC3HDAC2ALDH1A1
SCHEMBL6202001 0.80 HDAC2 (0.54) HDAC3HDAC2
SCHEMBL3786249 0.79 SMN1; SMN2 (0.45) MAPTLMNATSHRALDH1A1HPGD
SCHEMBL2733475 0.79 SMN1; SMN2 (0.42) MAPTLMNAALDH1A1HPGDKMT2A
SCHEMBL5228255 0.78 HDAC3 (0.59) MAPTNPSR1LMNAMAPK1TSHR
SCHEMBL3791523 0.78 SMN1; SMN2 (0.47) NPSR1LMNAMAPK1TSHRKDM4E

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 MAPT 3430/4885NPSR1 3236/4885LMNA 596/4885

“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.