SCHEMBL9730060

SCHEMBL9730060

COc1ccc(C(NC(=O)OCC2c3ccccc3-c3ccccc32)c2cc(C(C)C(=O)O)c(OC)cc2OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 2/20 0.47
▸ MDM4 O15151 3/20 0.42
▸ TP53 P04637 3/20 0.42
▸ CASP3 P42574 3/20 0.42
▸ FABP5 Q01469 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ATM Q13315 1/20 0.39
▸ EPHX2 P34913 1/20 0.39

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
SCHEMBL12555211 0.87 KMT2A (0.47) MDM2MDM4TP53CASP3FABP5
SCHEMBL7867949 0.85 MDM2 (0.43) MDM2MDM4TP53CASP3FABP5
SCHEMBL9706968 0.82 KMT2A (0.45) MDM2MDM4TP53CASP3FABP5
SCHEMBL4395836 0.82 KMT2A (0.45) MDM2MDM4TP53CASP3FABP5
SCHEMBL17192730 0.82 KMT2A (0.45) MDM2MDM4TP53CASP3FABP5
SCHEMBL8410923 0.82 KMT2A (0.45) MDM2MDM4TP53CASP3FABP5
SCHEMBL12873284 0.81 LMNA (0.46) MDM2MDM4TP53CASP3FABP5
SCHEMBL8377363 0.81 MDM2 (0.43) MDM2CASP3FABP5MEN1KMT2A
SCHEMBL6343752 0.81 KMT2A (0.45) MDM2MDM4TP53CASP3FABP5
SCHEMBL1745934 0.81 KMT2A (0.45) MDM2MDM4TP53CASP3FABP5

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
US-5124478-A ACID-LABILE ANCHOR GROUPS FOR THE SYNTHESIS OF PEPTIDE AMIDES BY A SOLID-PHASE METHOD HOECHST AKTIENGESELLSCHAFT (DE) 1992-06-23 — — US disclosed
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