SCHEMBL29401049

SCHEMBL29401049

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

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.60
▸ KMT2A Q03164 2/20 0.57
▸ MDM4 O15151 2/20 0.54
▸ TP53 P04637 2/20 0.54
▸ EPHX2 P34913 1/20 0.49
▸ MDM2 Q00987 3/20 0.48

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
SCHEMBL30988972 0.93 CASP3 (0.59) CASP3KMT2AMDM4TP53MDM2
SCHEMBL28641187 0.92 CASP3 (0.61) CASP3KMT2AMDM4TP53MDM2
SCHEMBL29400163 0.92 CASP3 (0.61) CASP3KMT2AMDM4TP53MDM2
SCHEMBL29401389 0.92 CASP3 (0.61) CASP3KMT2AMDM4TP53MDM2
SCHEMBL13163900 0.92 CASP3 (0.61) CASP3KMT2AMDM4TP53MDM2
SCHEMBL1486199 0.92 CASP3 (0.64) CASP3KMT2AMDM4TP53MDM2
SCHEMBL30055375 0.92 CASP3 (0.64) CASP3KMT2AMDM4TP53MDM2
SCHEMBL378040 0.92 CASP3 (0.64) CASP3KMT2AMDM4TP53MDM2
SCHEMBL378041 0.92 CASP3 (0.64) CASP3KMT2AMDM4TP53MDM2
SCHEMBL29352428 0.92 CASP3 (0.64) CASP3KMT2AMDM4TP53MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113072506-B Synthetic method of cyclic dipeptide containing aspartic acid and glutamic acid 陕西慧康生物科技有限责任公司 2022-05-27 — — CN claimed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 — — EP disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 — — US disclosed
CN-116829949-A Compositions for detecting or measuring analytes 伯蒂斯有限公司 2023-09-29 — — CN disclosed
WO-2023075435-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE 주식회사 베르티스 2023-05-04 — — WO disclosed
US-20220283131-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS CO., LTD. (KR) 2022-09-08 — — US disclosed
CN-113072506-B Synthetic method of cyclic dipeptide containing aspartic acid and glutamic acid 陕西慧康生物科技有限责任公司 2022-05-27 — — CN disclosed
CN-113072506-B Synthetic method of cyclic dipeptide containing aspartic acid and glutamic acid 陕西慧康生物科技有限责任公司 2022-05-27 — — CN disclosed
WO-2022050529-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE ㈜베르티스 2022-03-10 — — WO disclosed
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