SCHEMBL20184843

SCHEMBL20184843

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

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
EPHX2 P34913 1/20 0.44
FABP5 Q01469 3/20 0.43
FABP7 O15540 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CASP3 P42574 3/20 0.40

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
SCHEMBL27960451 1.00 KMT2A (0.47) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL30341743 0.89 KMT2A (0.49) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL2817872 0.85 KMT2A (0.42) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL28857903 0.84 KMT2A (0.50) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL8037760 0.82 KMT2A (0.42) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL15058849 0.82 KMT2A (0.55) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL29823519 0.82 KMT2A (0.48) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL17760519 0.82 KMT2A (0.48) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL19280973 0.82 KMT2A (0.45) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL23296943 0.81 KMT2A (0.44) KMT2AEPHX2FABP5FABP7CA1

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
EP-3327027-A1 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF Pfizer Inc (US) 2018-05-30 EP disclosed