SCHEMBL5281239

SCHEMBL5281239

O=C(COCc1ccc(F)cc1)NCCCc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCC(=O)N3)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
PKM P14618 5/20 0.43
BRD4 O60885 1/20 0.43
ADRB2 P07550 1/20 0.42
KMT2A Q03164 4/20 0.41
LMNA P02545 3/20 0.41
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 2/20 0.40
TP53 P04637 2/20 0.40
MEN1 O00255 2/20 0.40
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
PIK3CD O00329 1/20 0.39
PIK3R1 P27986 1/20 0.39
MTOR P42345 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
SCHEMBL5276612 0.85 MAPT (0.50) PKMKMT2ALMNAKDM4EMAPT
SCHEMBL5285905 0.85 LMNA (0.48) POLBPKMKMT2ALMNASMN1; SMN2
SCHEMBL5280994 0.83 LMNA (0.44) POLBPKMKMT2ALMNAKDM4E
SCHEMBL5277128 0.82 LMNA (0.47) POLBPKMKMT2ALMNASMN1; SMN2
SCHEMBL6038117 0.80 MAPT (0.49) POLBPKMKMT2ALMNASMN1; SMN2
SCHEMBL6038152 0.80 MAPT (0.49) PKMKMT2ALMNAKDM4ESMN1; SMN2
SCHEMBL5276893 0.80 LMNA (0.49) POLBKMT2ALMNASMN1; SMN2MAPT
SCHEMBL5288481 0.78 ALDH1A1 (0.53) POLBPKMKMT2ALMNASMN1; SMN2
SCHEMBL6037905 0.78 HDAC1 (0.54) POLBPKMKMT2ALMNASMN1; SMN2
SCHEMBL6037941 0.78 ALDH1A1 (0.49) POLBPKMKMT2ALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 EP claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US claimed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO claimed
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 POLB 820/4885PKM 2287/4885BRD4 112/4885

“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.