SCHEMBL24469448

SCHEMBL24469448

CCOP(=O)(CCCC(=O)N[C@@H](CC)C(=O)O)OCC

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 8/20 0.42
▸ PPARD Q03181 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ LPAR3 Q9UBY5 4/20 0.38
▸ FOLH1 Q04609 2/20 0.36
▸ SLC6A5 Q9Y345 1/20 0.35
▸ LPAR1 Q92633 2/20 0.34

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
SCHEMBL28944893 0.89 CA2 (0.48) NOD1PPARDKMT2APOLBLPAR3
SCHEMBL28944892 0.89 CA2 (0.48) NOD1PPARDKMT2APOLBLPAR3
SCHEMBL15623817 0.79 NOD1 (0.61) NOD1KMT2ASLC6A5
SCHEMBL22690652 0.77 KMT2A (0.36) NOD1PPARDKMT2APOLBLPAR3
SCHEMBL22690653 0.77 KMT2A (0.36) NOD1PPARDKMT2APOLBLPAR3
SCHEMBL4627107 0.76 NOD1 (0.62) NOD1KMT2ASLC6A5
SCHEMBL15680298 0.74 NOD1 (0.56) NOD1PPARDKMT2ASLC6A5
SCHEMBL9828089 0.74 NOD1 (0.70) NOD1KMT2ASLC6A5
SCHEMBL2383184 0.73 PPARD (0.54) PPARDKMT2A
SCHEMBL22503896 0.73 NOD1 (0.55) NOD1KMT2ASLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023225336-A1 MET BCL-XL INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF NOVARTIS AG (CH) 2023-11-23 — — WO disclosed
WO-2023225320-A1 EPHA2 BCL-XL INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF NOVARTIS AG (CH) 2023-11-23 — — WO disclosed
WO-2023225359-A1 ANTIBODY-DRUG CONJUGATES OF ANTINEOPLASTIC COMPOUNDS AND METHODS OF USE THEREOF NOVARTIS AG (CH) 2023-11-23 — — WO disclosed
WO-2022115451-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS AG (CH) 2022-06-02 — — WO disclosed
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