SCHEMBL4563290

SCHEMBL4563290

Cn1cc(OC(=O)Nc2ccccc2-c2ccc(F)c(F)c2F)c(C(F)(F)F)n1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 12/20 0.40
GAA P10253 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
DHODH Q02127 1/20 0.35
NPC1 O15118 1/20 0.35
ABCG2 Q9UNQ0 1/20 0.34

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
SCHEMBL3024592 0.90 CHRM3 (0.44) CHRM3GAALMNAPOLBNPC1
SCHEMBL3041242 0.87 CHRM3 (0.40) CHRM3LMNAPOLB
SCHEMBL3043533 0.87 CHRM3 (0.48) CHRM3GAALMNA
SCHEMBL4563652 0.87 CHRM3 (0.46) CHRM3GAALMNAPOLBNPC1
SCHEMBL3035362 0.86 CHRM3 (0.46) CHRM3NPC1
SCHEMBL3038580 0.85 CHRM3 (0.42) CHRM3GAALMNAPOLBNPC1
SCHEMBL5141264 0.84 POLB (0.43) CHRM3LMNAPOLBNPC1
SCHEMBL3046034 0.84 CHRM3 (0.47) CHRM3LMNAPOLBNPC1
SCHEMBL4563806 0.84 CHRM3 (0.42) CHRM3
SCHEMBL1128031 0.84 CHRM3 (0.40) CHRM3NPC1

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
EP-2066177-B1 FUNGICIDAL MIXTURES OF 1-METHYLPYRAZOLE-4-YLCARBOXYLIC ACID ANILIDES AND AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2014-12-24 EP claimed
EP-1856055-B1 PYRAZOLE CARBOXYLIC ACID ANILIDES, METHOD FOR THE PRODUCTION THEREOF AND AGENTS CONTAINING THEM FOR CONTROLLING PATHOGENIC FUNGI BASF SE (DE) 2014-10-01 EP claimed
EP-2066177-A2 FUNGICIDAL MIXTURES OF 1-METHYLPYRAZOLE-4-YLCARBOXYLIC ACID ANILIDES AND AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2009-06-10 EP claimed
WO-2008087182-A2 FUNGICIDAL MIXTURES OF 1-METHYLPYRAZOLE-4-YLCARBOXYLIC ACID ANILIDES AND AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2008-07-24 WO claimed
EP-1912503-A2 FUNGICIDAL MIXTURES CONTAINING SUBSTITUTED 1-METHYL PYRAZOL-4-YL CARBOXYLIC ACID ANILIDES BASF SE (DE) 2008-04-23 EP claimed
WO-2007017416-A2 FUNGICIDAL MIXTURES CONTAINING SUBSTITUTED 1-METHYL PYRAZOL-4-YL CARBOXYLIC ACID ANILIDES BASF SE (DE) 2007-02-15 WO claimed
EP-2066177-B1 FUNGICIDAL MIXTURES OF 1-METHYLPYRAZOLE-4-YLCARBOXYLIC ACID ANILIDES AND AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2014-12-24 EP disclosed
EP-2120553-B1 PRODUCTION OF SOLID SOLUTIONS OF PESTICIDES BY SHORT TERM SUPERHEATING AND RAPID DRYING BASF SE (DE) 2014-05-28 EP disclosed
EP-2120553-A2 PRODUCTION OF SOLID SOLUTIONS OF PESTICIDES BY SHORT TERM SUPERHEATING AND RAPID DRYING BASF SE (DE) 2009-11-25 EP disclosed
WO-2008065051-A2 PRODUCTION OF SOLID SOLUTIONS OF PESTICIDES BY SHORT TERM SUPERHEATING AND RAPID DRYING BASF SE (DE) 2008-06-05 WO disclosed