SCHEMBL8653790

SCHEMBL8653790

O=C(N[C@@H](CC=CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.59
▸ TP53 P04637 3/20 0.59
▸ CASP3 P42574 3/20 0.56
▸ MDM2 Q00987 5/20 0.52
▸ KMT2A Q03164 2/20 0.51
▸ SLC17A5 Q9NRA2 1/20 0.49

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
SCHEMBL8654704 1.00 MDM4 (0.59) MDM4TP53CASP3MDM2KMT2A
SCHEMBL9186701 1.00 MDM4 (0.59) MDM4TP53CASP3MDM2KMT2A
SCHEMBL8653785 1.00 MDM4 (0.59) MDM4TP53CASP3MDM2KMT2A
SCHEMBL16744159 0.94 CASP3 (0.54) MDM4TP53CASP3MDM2
SCHEMBL8227090 0.93 CASP3 (0.55) MDM4TP53CASP3MDM2KMT2A
SCHEMBL8234371 0.93 CASP3 (0.55) MDM4TP53CASP3MDM2KMT2A
SCHEMBL16744152 0.93 CASP3 (0.55) MDM4TP53CASP3MDM2KMT2A
SCHEMBL16744153 0.92 CASP3 (0.53) MDM4TP53CASP3MDM2
SCHEMBL2308310 0.92 MDM4 (0.54) MDM4TP53CASP3MDM2KMT2A
SCHEMBL120671 0.92 MDM4 (0.54) MDM4TP53CASP3MDM2KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673388-B1 DOUBLE CHAIN PEPTIDE COMPOUNDS HAVING HEMOREGULATORY ACTIVITY NYCOMED IMAGING AS (NO) 1998-10-14 — — EP disclosed
US-5610141-A CELL DIVISION STIMULANT NYCOMED IMAGING AS (NO) 1997-03-11 — — US disclosed
WO-1993024523-A1 DOUBLE CHAIN PEPTIDE COMPOUNDS HAVING HEMOREGULATORY ACTIVITY HAFSLUND NYCOMED AS (NO) 1993-12-09 — — WO disclosed
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