SCHEMBL6403396

SCHEMBL6403396

COc1cc(C2NC(=O)N(CCN(C)C)C(C)=C2C(=O)OC(C)C(C)(C)C)cc(C)c1O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.44
LMNA P02545 9/20 0.41
TSHR P16473 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
USP2 O75604 1/20 0.41
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL4649550 0.94 ALDH1A1 (0.41) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL4649545 0.92 GAA (0.38) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL6406891 0.88 ALDH1A1 (0.47) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL4646870 0.85 GAA (0.46) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL6409604 0.84 ALDH1A1 (0.49) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL6404449 0.80 GAA (0.54) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL6404869 0.79 GAA (0.56) GAALMNATSHRL3MBTL1KMT2A
SCHEMBL6409849 0.78 GAA (0.52) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL4686505 0.76 GAA (0.53) GAALMNATSHRSMN1; SMN2USP2
SCHEMBL6406182 0.76 GAA (0.49) GAALMNATSHRSMN1; SMN2USP2

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
US-20050282838-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2005-12-22 US claimed
US-20050282838-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2005-12-22 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-20050282838-A1 Compounds, compositions, and methods PCNA, MKI67, TP53 GAA 349/4885LMNA 233/4885TSHR 4678/4885

“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.