SCHEMBL24805405

SCHEMBL24805405

CC(C)(C)C(=O)NC(CCCNC(N)=O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ C3AR1 Q16581 1/20 0.48
▸ CTDSP1 Q9GZU7 1/20 0.42
▸ FOLH1 Q04609 5/20 0.41
▸ SHMT1 P34896 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ KLK7 P49862 1/20 0.39
▸ NOD1 Q9Y239 3/20 0.39
▸ POLB P06746 2/20 0.38
▸ GRIA1 P42261 1/20 0.37
▸ GNPAT O15228 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL31184429 0.89 C3AR1 (0.47) C3AR1CTDSP1FOLH1SHMT1MEN1
SCHEMBL1724846 0.88 FOLH1 (0.40) C3AR1FOLH1MEN1KMT2AGAA
SCHEMBL4552682 0.88 FOLH1 (0.40) C3AR1FOLH1MEN1KMT2AGAA
SCHEMBL28670837 0.84 FOLH1 (0.50) FOLH1NOD1POLBSMN1; SMN2
SCHEMBL28670835 0.84 FOLH1 (0.50) FOLH1NOD1POLBSMN1; SMN2
SCHEMBL5497852 0.83 C3AR1 (0.55) C3AR1CTDSP1FOLH1SHMT1MEN1
SCHEMBL5497855 0.83 C3AR1 (0.55) C3AR1CTDSP1FOLH1SHMT1MEN1
SCHEMBL18876678 0.83 NOD1 (0.46) FOLH1NOD1GNPATSMN1; SMN2
SCHEMBL468875 0.82 FOLH1 (0.51) C3AR1CTDSP1FOLH1SHMT1MEN1
SCHEMBL468877 0.82 FOLH1 (0.51) C3AR1CTDSP1FOLH1SHMT1MEN1

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
WO-2022266753-A1 BIVALENT COMPOUNDS, CONJUGATES AND USES THEREOF Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2022-12-29 — — WO disclosed
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