SCHEMBL8979475

SCHEMBL8979475

COc1cc(O)ccc1[C@@H]1O[C@@H](CC(=O)O)C(=O)N(CC(C)(C)C)c2ccc(Cl)cc21

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 18/20 0.68

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
SCHEMBL8559105 1.00 FDFT1 (0.68) FDFT1
SCHEMBL8979483 1.00 FDFT1 (0.68) FDFT1
SCHEMBL8504019 0.91 FDFT1 (0.68) FDFT1
SCHEMBL8501047 0.91 FDFT1 (0.68) FDFT1
SCHEMBL4111102 0.91 FDFT1 (0.68) FDFT1
SCHEMBL8501597 0.90 FDFT1 (0.56) FDFT1
SCHEMBL8501591 0.90 FDFT1 (0.56) FDFT1
SCHEMBL6953603 0.90 FDFT1 (0.75) FDFT1
SCHEMBL6953607 0.90 FDFT1 (0.75) FDFT1
SCHEMBL6953604 0.90 FDFT1 (0.75) FDFT1

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-0710725-A1 Production of optically active compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed