SCHEMBL5478909

SCHEMBL5478909

Cc1nn(C(=O)OC(C)(C)C)c2cc(-c3cc(OC[C@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)cnc3Cl)sc12

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 14/20 0.48
HDAC4 P56524 14/20 0.48
HDAC1 Q13547 14/20 0.48
HDAC7 Q8WUI4 14/20 0.48
HDAC2 Q92769 14/20 0.48
HDAC10 Q969S8 14/20 0.48
HDAC11 Q96DB2 14/20 0.48
HDAC8 Q9BY41 14/20 0.48
HDAC6 Q9UBN7 14/20 0.48
HDAC9 Q9UKV0 14/20 0.48
HDAC5 Q9UQL6 14/20 0.48
TACR1 P25103 2/20 0.42
SSTR3 P32745 1/20 0.41
CYP3A4 P08684 2/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL5478913 1.00 HDAC3 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL4659672 0.94 HDAC3 (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6855816 0.81 AKT1 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6855822 0.81 AKT1 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL14430155 0.78 HDAC3 (0.63) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL14430156 0.78 HDAC3 (0.52) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL14430216 0.77 HDAC3 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6853663 0.76 AKT1 (0.68) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6853666 0.76 AKT1 (0.68) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL4061469 0.76 HDAC3 (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185152-A1 Inhibitors of akt activity SMITHKLINE BEECHAM CORPORATION 2007-08-09 US 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-20070185152-A1 Inhibitors of akt activity AKT1, AKT1S1, AKT2 HDAC3 995/4885HDAC4 616/4885HDAC1 372/4885

“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.