SCHEMBL24469367

SCHEMBL24469367

CNC(C(=O)N[C@@H](C)C(C)=O)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL17209934 1.00 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL25597040 1.00 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL25599185 1.00 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL21699485 1.00 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL18179643 1.00 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL25668291 0.86 XIAP (0.36)
SCHEMBL22192668 0.84 DPP4 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL19201191 0.83 FFAR2 (0.32)
SCHEMBL23105983 0.83
SCHEMBL19201193 0.83 FFAR2 (0.32)

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-2022115451-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS AG (CH) 2022-06-02 WO disclosed