SCHEMBL28611044

SCHEMBL28611044

COC(=O)C(N)CC(=O)OO

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ SLC1A1 P43005 1/20 0.34
▸ TSHR P16473 3/20 0.33
▸ KIF11 P52732 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MGAM O43451 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ SI P14410 2/20 0.31
▸ MGAM2 Q2M2H8 2/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ LTA4H P09960 1/20 0.31
▸ CA14 Q9ULX7 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
SCHEMBL196760 0.86 TSHR (0.42) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
SCHEMBL196759 0.86 TSHR (0.42) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
SCHEMBL12286780 0.86 TSHR (0.42) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
Iodide SCHEMBL17393001 0.84 TSHR (0.40) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
Hydrochloric Acid SCHEMBL1802204 0.84 TSHR (0.40) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
SCHEMBL25491151 0.84 SMN1; SMN2 (0.36) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
Hydrochloric Acid SCHEMBL8968568 0.84 TSHR (0.40) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
Hydrochloric Acid SCHEMBL9538568 0.84 TSHR (0.40) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
Hydrochloric Acid SCHEMBL9538572 0.84 TSHR (0.40) SMN1; SMN2SLC1A1TSHRKIF11KMT2A
Hydrochloric Acid SCHEMBL1802201 0.84 TSHR (0.40) SMN1; SMN2SLC1A1TSHRKIF11KMT2A

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
CN-113057921-A Anti-aging eye cream and preparation method thereof 深圳市前海汇邦国际物流供应链有限公司 2021-07-02 — — CN disclosed
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