SCHEMBL5160904

SCHEMBL5160904

CCOC(C(=O)OC(C)(C)C)N1CCC[C@H]1C(=O)NCC(=O)CCC(=O)OC

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
TSHR P16473 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CMA1 P23946 1/20 0.30

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
SCHEMBL5163685 0.80 FKBP1A (0.41) SMN1; SMN2ALDH1A1POLBKMT2AMEN1
SCHEMBL5159936 0.77 RAB9A (0.40) SMN1; SMN2ALDH1A1KMT2AMEN1KDM4E
SCHEMBL6179708 0.77 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1POLBKMT2AMEN1
SCHEMBL5161578 0.77 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1POLBKMT2AMEN1
SCHEMBL5160942 0.74 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1POLBKMT2ATSHR
SCHEMBL5160897 0.71 HCRTR2 (0.33) SMN1; SMN2POLBKMT2ACMA1
SCHEMBL27562911 0.70 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1POLBKMT2AMEN1
SCHEMBL14371775 0.69 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1KDM4EHSD17B10
SCHEMBL5163503 0.69 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1KDM4EHSD17B10
SCHEMBL5160887 0.69 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1KDM4EHSD17B10

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-20070232601-A1 Vla-4 Inhibitor DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-10-04 US disclosed
EP-1757602-A1 VLA-4 INHIBITOR DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-02-28 EP 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-20070232601-A1 Vla-4 Inhibitor VCAM1, ITGB4, ITGA4 SMN1; SMN2 3016/4885ALDH1A1 471/4885POLB 3774/4885

“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.