SCHEMBL7088568

SCHEMBL7088568

CCOC(=O)CCNC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.54
▸ MGAM O43451 1/20 0.54
▸ SI P14410 1/20 0.54
▸ MGAM2 Q2M2H8 1/20 0.54
▸ CYP1A2 P05177 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.45
▸ TOP2A P11388 1/20 0.45
▸ TRPA1 O75762 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ EGLN1 Q9GZT9 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ LTA4H P09960 1/20 0.40
▸ CYP4F2 P78329 1/20 0.40
▸ CYP4A11 Q02928 1/20 0.40

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
SCHEMBL27805389 0.85 GAA (0.48) GAAMGAMSIMGAM2CYP1A2
SCHEMBL15201482 0.84 GAA (0.52) GAAMGAMSIMGAM2CYP1A2
SCHEMBL1425763 0.84 GAA (0.52) GAAMGAMSIMGAM2CYP1A2
SCHEMBL48439 0.84 GAA (0.52) GAAMGAMSIMGAM2CYP1A2
Hydrochloric Acid SCHEMBL5622666 0.84 GAA (0.52) GAAMGAMSIMGAM2CYP1A2
SCHEMBL5571264 0.83 KMT2A (0.52) GAAMGAMSIMGAM2CYP1A2
SCHEMBL3220536 0.83 GAA (0.56) GAAMGAMSIMGAM2CYP1A2
SCHEMBL2906712 0.83 GAA (0.50) GAAMGAMSIMGAM2CYP1A2
SCHEMBL10055154 0.83 GAA (0.50) GAAMGAMSIMGAM2CYP1A2
SCHEMBL8530664 0.82 GAA (0.49) GAAMGAMSIMGAM2CYP1A2

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-20030199698-A1 Carbamic acid esters as inhibitors of factor xa MERCK PATENT GMBH (DE) 2003-10-23 — — 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-20030199698-A1 Carbamic acid esters as inhibitors of factor xa F11, F12, F13A1 GAA 1547/4885MGAM 2954/4885SI 1504/4885

“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.

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