SCHEMBL6412224

SCHEMBL6412224

Cc1ccc(-n2c(COc3ccccc3)nnc2SC(C)C(=O)O)cc1

nearest known ligand 0.92

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.92
ALDH1A1 P00352 2/20 0.71
LMNA P02545 2/20 0.68
L3MBTL1 Q9Y468 2/20 0.68
VCP P55072 9/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
HTT P42858 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
POLB P06746 1/20 0.59
RECQL P46063 1/20 0.57

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
SCHEMBL6403317 0.96 PKM (1.00) PKMALDH1A1LMNAL3MBTL1VCP
SCHEMBL6405019 0.93 PKM (0.87) PKMALDH1A1LMNAL3MBTL1VCP
SCHEMBL6403187 0.88 VCP (0.86) PKMALDH1A1LMNAVCPSMN1; SMN2
SCHEMBL6403407 0.83 PKM (0.74) PKMALDH1A1LMNAL3MBTL1VCP
SCHEMBL6405241 0.82 L3MBTL1 (0.84) PKMALDH1A1LMNAL3MBTL1VCP
SCHEMBL6405274 0.82 GAA (0.74) PKMALDH1A1LMNAL3MBTL1VCP
SCHEMBL6404082 0.80 RXRA (0.74) PKMALDH1A1LMNAL3MBTL1VCP
SCHEMBL6408255 0.76 POLB (0.73) PKMALDH1A1LMNAL3MBTL1POLB
SCHEMBL6402672 0.75 DGAT1 (0.57) PKMALDH1A1LMNAL3MBTL1POLB
SCHEMBL11887417 0.73 KMT2A (0.80) ALDH1A1LMNAL3MBTL1VCPSMN1; SMN2

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-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof AGRIUS GROUP, LLC. 2005-12-29 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-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof ABCG2, ATP5ME, DNTT PKM 2155/4885ALDH1A1 720/4885LMNA 4116/4885

“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.