SCHEMBL30065486

SCHEMBL30065486

CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@H](CC(=O)O)Cc1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.42
FABP5 Q01469 3/20 0.40
FABP7 O15540 2/20 0.40
KMT2A Q03164 2/20 0.38
NPY5R Q15761 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
CYP1A2 P05177 1/20 0.36
TSHR P16473 1/20 0.36
MAOB P27338 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
SCHEMBL21994848 1.00 CASP3 (0.42) CASP3FABP5FABP7KMT2ANPY5R
SCHEMBL21994849 1.00 CASP3 (0.42) CASP3FABP5FABP7KMT2ANPY5R
SCHEMBL21978041 0.87 CASP3 (0.36) CASP3FABP5FABP7KMT2ANPY5R
SCHEMBL21978042 0.87 CASP3 (0.36) CASP3FABP5FABP7KMT2ANPY5R
SCHEMBL21978223 0.86 MEN1 (0.41) CASP3KMT2A
SCHEMBL21978221 0.86 MEN1 (0.41) CASP3KMT2A
SCHEMBL21978457 0.86 CASP3 (0.36) CASP3FABP5FABP7KMT2ANPY5R
SCHEMBL26754271 0.86 MEN1 (0.41) CASP3KMT2A
SCHEMBL21994344 0.86 FABP5 (0.39) CASP3FABP5FABP7KMT2APPARG
SCHEMBL21994347 0.86 FABP5 (0.39) CASP3FABP5FABP7KMT2APPARG

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
EP-4100064-A1 TARGETED PLASMA PROTEIN DEGRADATION Novartis AG (CH) 2022-12-14 EP disclosed