SCHEMBL6842698

SCHEMBL6842698

Nc1ccc(F)cc1NC(=O)c1ccc(CNC(=O)C=Cc2ccccc2)cc1

nearest known ligand 0.85

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 0.85
HDAC2 Q92769 10/20 0.85
HDAC3 O15379 7/20 0.85
NCOR2 Q9Y618 3/20 0.85
HDAC4 P56524 4/20 0.79
HDAC7 Q8WUI4 4/20 0.79
HDAC10 Q969S8 4/20 0.79
HDAC11 Q96DB2 4/20 0.79
HDAC8 Q9BY41 4/20 0.79
HDAC6 Q9UBN7 4/20 0.79
HDAC9 Q9UKV0 4/20 0.79
HDAC5 Q9UQL6 4/20 0.79
NCOR1 O75376 1/20 0.79
KCNH2 Q12809 1/20 0.79
NAMPT P43490 2/20 0.68
MMP1 P03956 1/20 0.54
MMP2 P08253 1/20 0.54
MMP9 P14780 1/20 0.54

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
SCHEMBL6842697 1.00 HDAC1 (0.85) HDAC1HDAC2HDAC3NCOR2HDAC4
SCHEMBL4476526 0.92 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4
SCHEMBL4476529 0.92 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4
SCHEMBL30267913 0.89 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4
SCHEMBL8057949 0.89 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4
SCHEMBL5500152 0.89 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4
SCHEMBL28456829 0.86 HDAC1 (0.71) HDAC1HDAC2HDAC3NCOR2HDAC4
Tucidinostat SCHEMBL4483082 0.81 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4
Tucidinostat SCHEMBL29350211 0.81 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4
Tucidinostat SCHEMBL29813059 0.81 HDAC1 (1.00) HDAC1HDAC2HDAC3NCOR2HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2860174-A2 Histone deacetylase inhibitors of novel benzamide derivatives with potent differentiation and anti-proliferation acivity Shenzhen Chipscreen Biosciences Ltd. (CN) 2015-04-15 EP disclosed
US-20040224991-A1 Histone deacetylase inhibitors of novel benzamide derivatives with potent differentiation and anti-proliferation activity SHENZHEN CHIPSCREEN BIOSCIENCES LTD. (CN) 2004-11-11 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-20040224991-A1 Histone deacetylase inhibitors of novel benzamide derivatives with potent differentiation and anti-proliferation activity HDAC1, HDAC5, HDAC11 HDAC1 1/4885HDAC2 7/4885HDAC3 12/4885

“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.