SCHEMBL5585756

SCHEMBL5585756

CNC(=O)c1ccc([AsH2])c([AsH2])c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.52
HDAC6 Q9UBN7 2/20 0.52
HDAC2 Q92769 1/20 0.52
PLAU P00749 1/20 0.49
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PLK1 P53350 7/20 0.47
THRB P10828 1/20 0.45
CA2 P00918 1/20 0.44
MMP13 P45452 1/20 0.43

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
SCHEMBL250247 0.77 HDAC6 (0.80) HDAC8HDAC6HDAC2PLAUHPGD
SCHEMBL4555705 0.76 HDAC8 (0.64) HDAC8HDAC6HDAC2PLAUHPGD
SCHEMBL4672838 0.75 CA1 (0.57) HPGDTSHRHTTSMN1; SMN2CA2
SCHEMBL5909363 0.73 HDAC8 (0.83) HDAC8HDAC6HDAC2PLAUHPGD
SCHEMBL31627721 0.73 TSHR (0.52) TSHRSMN1; SMN2CA2
SCHEMBL4141704 0.72 KMT2A (0.56) HDAC8HDAC6HDAC2PLAUHPGD
SCHEMBL328702 0.72 HDAC6 (0.67) HDAC8HDAC6HDAC2PLAUHPGD
SCHEMBL16521645 0.72 HDAC8 (0.54) HDAC8HDAC6HDAC2PLAUHPGD
SCHEMBL21968466 0.72 HDAC8 (0.52) HDAC8HDAC6HDAC2PLAUHPGD
SCHEMBL4478521 0.71 HDAC8 (0.60) HDAC8HDAC6HDAC2PLAUHPGD

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-20070065443-A1 Fructoseamine 3 kinase and the formation of collagen and elastin DYNAMIS THERAPEUTICS, INC. 2007-03-22 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-20070065443-A1 Fructoseamine 3 kinase and the formation of collagen and elastin FN3K, PDXK, COLGALT1 HDAC8 3072/4885HDAC6 3324/4885HDAC2 2294/4885

“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.