SCHEMBL8765219

SCHEMBL8765219

Cc1c(C(F)(F)C(F)(F)F)noc1N

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.35
BRD4 O60885 1/20 0.32

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
SCHEMBL6294438 0.83 MLYCD (0.40) MLYCDBRD4
SCHEMBL573503 0.76 NPC1 (0.32) BRD4
SCHEMBL8765651 0.67 IDO1 (0.33)
SCHEMBL402583 0.64
SCHEMBL15870336 0.64
SCHEMBL10503592 0.63 MLYCD (0.64) MLYCDBRD4
Hydrochloric Acid SCHEMBL28751278 0.62
SCHEMBL8764273 0.61 MLYCD (0.40) MLYCDBRD4
SCHEMBL6610363 0.61 MLYCD (0.33) MLYCDBRD4
SCHEMBL8764860 0.61 MLYCD (0.44) MLYCDBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4797492-A INTERMEDIATES FOR BACTERICIDES; HERBICIDES OR FUNGICIDES SHIONOGI & CO., LTD. (JP) 1989-01-10 US claimed
EP-0375670-B1 Process for preparing 3-polyfluoroalkylisoxazolylamines SHIONOGI & CO (JP) 1997-08-06 EP disclosed
EP-0220947-B1 Polyfluoroalkylisoxazolylamines, their preparation and use SHIONOGI & CO (JP) 1994-06-15 EP disclosed
EP-0375670-A2 Process for preparing 3-polyfluoroalkylisoxazolylamines SHIONOGI & CO., LTD. (JP) 1990-06-27 EP disclosed
US-4910326-A β-ketonitrils SHIONOGI & CO., LTD. (JP) 1990-03-20 US disclosed
EP-0304966-A2 Beta-ketonitriles SHIONOGI & CO., LTD. (JP) 1989-03-01 EP disclosed
US-4797492-A INTERMEDIATES FOR BACTERICIDES; HERBICIDES OR FUNGICIDES SHIONOGI & CO., LTD. (JP) 1989-01-10 US disclosed
EP-0220947-A2 Polyfluoroalkylisoxazolylamines, their preparation and use SHIONOGI & CO., LTD. (JP) 1987-05-06 EP disclosed