SCHEMBL8559517

SCHEMBL8559517

CCOC(=O)C[C@@H]1O[C@@H](c2ccccc2Cl)c2cc(Cl)ccc2N(CC(C)(C)C)C1=O

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 16/20 0.53

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
SCHEMBL8559528 1.00 FDFT1 (0.53) FDFT1
SCHEMBL4290556 0.92 FDFT1 (0.53) FDFT1
SCHEMBL8565883 0.91 FDFT1 (0.61) FDFT1
SCHEMBL8565878 0.91 FDFT1 (0.61) FDFT1
SCHEMBL6951790 0.88 FDFT1 (0.51) FDFT1
SCHEMBL6958525 0.88 FDFT1 (0.51) FDFT1
SCHEMBL6958743 0.88 FDFT1 (0.64) FDFT1
SCHEMBL6957625 0.88 FDFT1 (0.55) FDFT1
SCHEMBL9057751 0.88 FDFT1 (0.64) FDFT1
SCHEMBL4105096 0.88 FDFT1 (0.64) 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
US-5770438-A CHEMICAL INTERMEDIATES FOR ANTICHOLESTEROL COMPOUNDS, CYCLIZATION TO FORM BENZOXAZEPINE OR BENZOTHIAZEPINE COMPOUNDS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-23 US disclosed