SCHEMBL9656785

SCHEMBL9656785

Cc1cc(COc2ccccc2Cc2ccccc2)n(O)c(=O)c1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 20/20 0.67

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
SCHEMBL1858561 0.84 IDH1 (0.80) IDH1
SCHEMBL9657979 0.81 IDH1 (0.67) IDH1
SCHEMBL10723992 0.81 IDH1 (1.00) IDH1
SCHEMBL10724044 0.80 IDH1 (1.00) IDH1
SCHEMBL9658497 0.80 IDH1 (0.68) IDH1
SCHEMBL9658531 0.79 IDH1 (0.61) IDH1
SCHEMBL1859786 0.75 IDH1 (0.84) IDH1
SCHEMBL9656711 0.75 IDH1 (0.62) IDH1
SCHEMBL9657407 0.74 IDH1 (0.67) IDH1
SCHEMBL1862320 0.74 IDH1 (0.74) IDH1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241918-B1 1-HYDROXY-2-PYRIDINONES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM, AS WELL AS INTERMEDIATES FORMED BY THE PREPARATION OF 1-HYDROXY-2-PYRIDINONES HOECHST AKTIENGESELLSCHAFT (DE) 1992-05-27 EP disclosed
US-4797409-A FUNGICIDES, YEAST INFECTIONS HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-10 US disclosed
EP-0241918-A2 1-Hydroxy-2-pyridinones, process for their preparation and medicines containing them, as well as intermediates formed by the preparation of 1-hydroxy-2-pyridinones HOECHST AKTIENGESELLSCHAFT (DE) 1987-10-21 EP disclosed