SCHEMBL4564306

SCHEMBL4564306

Cc1cc(-c2ccccc2NC(=O)Oc2cn(C)nc2C(F)F)c(F)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 16/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
STIM1 Q13586 1/20 0.34
ORAI1 Q96D31 1/20 0.34
DHODH Q02127 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL4563672 0.90 KMT2A (0.40) CHRM3MEN1KMT2AKDM4EALDH1A1
SCHEMBL2843544 0.89 CHRM3 (0.46) CHRM3KDM4EALDH1A1
SCHEMBL3041879 0.86 CHRM3 (0.42) CHRM3MEN1KMT2ASTIM1ORAI1
SCHEMBL3036503 0.86 CHRM3 (0.38) CHRM3MEN1KMT2ADHODH
SCHEMBL3039851 0.85 CHRM3 (0.44) CHRM3KMT2AKDM4EALDH1A1
SCHEMBL5140807 0.85 MEN1 (0.41) CHRM3MEN1KMT2ASTIM1ORAI1
SCHEMBL4836876 0.85 CHRM3 (0.39) CHRM3MEN1KMT2AKDM4EALDH1A1
SCHEMBL1086034 0.85 ATM (0.43) CHRM3MEN1KMT2ASTIM1ORAI1
SCHEMBL3800595 0.85 CHRM3 (0.40) CHRM3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3805880 0.85 CHRM3 (0.48) CHRM3MEN1KMT2AKDM4EALDH1A1

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 9 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-A1 PYRAZOLE CARBOXYLIC ACID ANILIDES, METHOD FOR THE PRODUCTION THEREOF AND AGENTS CONTAINING THEM FOR CONTROLLING PATHOGENIC FUNGI BASF AKTIENGESELLSCHAFT (DE) 2007-11-21 EP claimed
WO-2006087343-A1 PYRAZOLE CARBOXYLIC ACID ANILIDES, METHOD FOR THE PRODUCTION THEREOF AND AGENTS CONTAINING THEM FOR CONTROLLING PATHOGENIC FUNGI BASF AKTIENGESELLSCHAFT (DE) 2006-08-24 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
EP-1912503-A2 FUNGICIDAL MIXTURES CONTAINING SUBSTITUTED 1-METHYL PYRAZOL-4-YL CARBOXYLIC ACID ANILIDES BASF SE (DE) 2008-04-23 EP disclosed
WO-2007017416-A2 FUNGICIDAL MIXTURES CONTAINING SUBSTITUTED 1-METHYL PYRAZOL-4-YL CARBOXYLIC ACID ANILIDES BASF SE (DE) 2007-02-15 WO disclosed