SCHEMBL24633706

SCHEMBL24633706

O=C(NC(Cc1ccccc1Cl)C(=O)O)OCC1C2=C(CCC=C2)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.43
TP53 P04637 3/20 0.43
MDM2 Q00987 6/20 0.39
SLC17A5 Q9NRA2 1/20 0.38
CASP3 P42574 2/20 0.37
GPR132 Q9UNW8 1/20 0.36
FABP7 O15540 1/20 0.36
FABP5 Q01469 1/20 0.36
TLR2 O60603 1/20 0.36

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
SCHEMBL3728954 0.85 MDM4 (0.54) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL119285 0.85 MDM4 (0.54) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL29401217 0.85 MDM4 (0.54) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL29775608 0.85 MDM4 (0.54) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL29401300 0.85 MDM4 (0.54) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL120599 0.85 MDM4 (0.54) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL24633696 0.83 MDM4 (0.46) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL27413465 0.82 MDM2 (0.49) MDM4TP53MDM2GPR132
SCHEMBL20112950 0.80 MDM4 (0.40) MDM4TP53MDM2GPR132
SCHEMBL10076575 0.80 CASP3 (0.41) MDM4TP53CASP3

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-2022234853-A1 CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS 中外製薬株式会社 2022-11-10 WO disclosed