SCHEMBL6038367

SCHEMBL6038367

COC(=O)C(C)(C)Cc1nc(CCCCCNC(=O)COCc2ccc(F)cc2)cs1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.41
LMNA P02545 4/20 0.41
HDAC1 Q13547 4/20 0.41
HDAC6 Q9UBN7 4/20 0.41
DDR2 Q16832 2/20 0.37
MAPK14 Q16539 1/20 0.37
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL5277732 0.87 RAB9A (0.50) TP53LMNAHDAC1HDAC6DDR2
SCHEMBL5282822 0.85 HDAC1 (0.46) TP53LMNAHDAC1HDAC6RAB9A
SCHEMBL5290863 0.85 HDAC1 (0.44) TP53LMNAHDAC1HDAC6GAA
SCHEMBL6038118 0.83 HDAC1 (0.39) TP53LMNAHDAC1HDAC6DDR2
SCHEMBL6038370 0.82 TP53 (0.39) TP53LMNAHDAC1HDAC6DDR2
SCHEMBL6038003 0.81 TP53 (0.51) TP53LMNAHDAC1HDAC6POLB
SCHEMBL5282979 0.81 TP53 (0.43) TP53LMNAHDAC1HDAC6POLB
SCHEMBL5280650 0.81 RAB9A (0.45) TP53LMNAHDAC1HDAC6RAB9A
SCHEMBL5282375 0.79 AOC3 (0.47) TP53LMNADDR2MAPK14RAB9A
SCHEMBL5281003 0.79 TP53 (0.68) TP53LMNAPOLBGAAL3MBTL1

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-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 TP53 2551/4885LMNA 851/4885HDAC1 1/4885

“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.