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SCHEMBL28041336

SCHEMBL28041336

CC(C)C(N)C(=O)N(C(=O)OCC1c2ccccc2-c2ccccc21)C(C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.41
▸ FABP5 Q01469 3/20 0.40
▸ FABP7 O15540 2/20 0.40
▸ CASP3 P42574 3/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ MDM4 O15151 1/20 0.36
▸ TP53 P04637 1/20 0.36

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
SCHEMBL28041333 1.00 KMT2A (0.41) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL29913804 0.88 FABP5 (0.47) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL28347157 0.83 FABP5 (0.45) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL28347155 0.83 FABP5 (0.45) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL30216525 0.81 KMT2A (0.46) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL30683550 0.81 KMT2A (0.46) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL23038627 0.81 FABP5 (0.41) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL23038626 0.81 FABP5 (0.41) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL30983379 0.80 KMT2A (0.48) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL16095352 0.79 FABP5 (0.46) KMT2AFABP5FABP7CASP3EPHX2

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
CN-105121421-A Spliceostatin analogs PFIZER 2015-12-02 — — CN disclosed