SCHEMBL6406891

SCHEMBL6406891

CCN1C(=O)NC(c2cc(C)c(O)c(OC)c2)C(C(=O)OC(C)C(C)(C)C)=C1C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
TSHR P16473 2/20 0.46
GAA P10253 6/20 0.45
LMNA P02545 3/20 0.43
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.38
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37

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
SCHEMBL6404449 0.91 GAA (0.54) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL4649550 0.90 ALDH1A1 (0.41) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL6409604 0.90 ALDH1A1 (0.49) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL6403396 0.88 GAA (0.44) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL4649545 0.88 GAA (0.38) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL4648983 0.84 ALDH1A1 (0.53) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL6409849 0.82 GAA (0.52) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL4686505 0.82 GAA (0.53) ALDH1A1TSHRGAALMNAUSP2
SCHEMBL6404869 0.81 GAA (0.56) ALDH1A1TSHRGAALMNAHTT
SCHEMBL6406182 0.80 GAA (0.49) ALDH1A1TSHRGAALMNAUSP2

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 ALDH1A1 1008/4885TSHR 4678/4885GAA 349/4885

“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.