SCHEMBL27988674

SCHEMBL27988674

NC(=O)C(N)C(=O)C(N)CSC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.65
DNMT1 P26358 1/20 0.61

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
SCHEMBL27988671 1.00 KIF11 (0.65) KIF11DNMT1
SCHEMBL7753308 0.87 KIF11 (0.68) KIF11DNMT1
SCHEMBL2838308 0.87 KIF11 (0.68) KIF11DNMT1
SCHEMBL15978681 0.87 KIF11 (0.68) KIF11DNMT1
S-Trityl-L-Cysteine SCHEMBL768203 0.82 KIF11 (0.85) KIF11DNMT1
S-Trityl-L-Cysteine SCHEMBL6891349 0.82 KIF11 (0.85) KIF11DNMT1
S-Trityl-L-Cysteine SCHEMBL768202 0.82 KIF11 (0.85) KIF11DNMT1
S-Trityl-L-Cysteine SCHEMBL11190175 0.81 KIF11 (0.82) KIF11DNMT1
S-Trityl-L-Cysteine SCHEMBL655692 0.81 KIF11 (0.82) KIF11DNMT1
S-Trityl-L-Cysteine SCHEMBL11190178 0.81 KIF11 (0.82) KIF11DNMT1

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-104144705-A TYROSINE BASED LINKERS FOR THE RELEASABLE CONNECTION OF PEPTIDES BAYER IP GMBH 2014-11-12 CN disclosed