SCHEMBL452750

SCHEMBL452750

Clc1nsc(Cl)c1Cl

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11459500 0.75
SCHEMBL1720826 0.69
SCHEMBL18513527 0.69
SCHEMBL14184756 0.69
SCHEMBL22314732 0.65
SCHEMBL1466227 0.65
SCHEMBL7085358 0.64
SCHEMBL12806940 0.64
SCHEMBL12733947 0.64
SCHEMBL11927337 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470739-B2 Isothiazolyloxyphenylamidines and their use as fungicides BAYER CROPSCIENE AG (DE) 2013-06-25 US disclosed
US-8138211-B2 Isothiazolyloxyphenylamidines and their use as fungicides BAYER CROPSCIENCE AG (DE) 2012-03-20 US disclosed
US-20120065061-A1 ISOTHIAZOLYLOXYPHENYLAMIDINES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2012-03-15 US disclosed
EP-2391612-A1 Isothiazolyloxyphenyl amidines and use thereof as fungicides Bayer CropScience AG (DE) 2011-12-07 EP disclosed
US-20110130282-A1 Isothiazolyloxyphenylamidines and their use as fungicides BAYER CROPSCIENCE AG (DE) 2011-06-02 US disclosed
WO-2010086118-A1 ISOTHIAZOLYLOXYPHENYL AMIDINES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-08-05 WO disclosed
US-4841063-A ANTIBACTERIAL, ANTIFUNGAL GIVAUDAN CORPORATION (US) 1989-06-20 US disclosed
US-4508908-A REACT WITH OXYGEN SOURCE TO PRODUCE 4-ISOTHIAZOLIN-3-ONE-USEFUL ASBACTERICIDES, FUNGICIDES GIVAUDAN CORPORATION (US) 1985-04-02 US disclosed
US-4328347-A BACTERICIDES, FUNGICIDES GIVAUDAN CORPORATION (US) 1982-05-04 US disclosed
US-4281136-A FUNGICIDES, BACTERICIDES GIVAUDAN CORPORATION (US) 1981-07-28 US disclosed