SCHEMBL6901572

SCHEMBL6901572

CCCCOCC(Cl)C(=O)Nc1c(CC)cccc1CC

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NLRP3 Q96P20 1/20 0.40
ANPEP P15144 1/20 0.40
POLB P06746 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CACNA1C Q13936 2/20 0.37
SCN5A Q14524 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL8074511 0.87 ATM (0.46) MEN1KMT2ANLRP3ANPEPALOX15
SCHEMBL9761567 0.85 NLRP3 (0.44) TDP1MEN1KMT2ANLRP3ANPEP
SCHEMBL5087609 0.80 NR1I2 (0.43) TDP1MEN1KMT2ANLRP3ANPEP
SCHEMBL10969651 0.80 NLRP3 (0.35) TDP1MEN1KMT2ANLRP3ANPEP
SCHEMBL9644400 0.80 NLRP3 (0.39) TDP1MEN1KMT2ANLRP3ANPEP
SCHEMBL8462752 0.80 NLRP3 (0.39) TDP1MEN1KMT2ANLRP3ANPEP
SCHEMBL3474559 0.79 NLRP3 (0.52) TDP1MEN1KMT2ANLRP3POLB
SCHEMBL10735359 0.78 ATM (0.36) MEN1KMT2ATSHR
SCHEMBL9845475 0.77 ALDH1A1 (0.41) TDP1MEN1KMT2ANLRP3ANPEP
SCHEMBL9614032 0.77 ANPEP (0.47) TDP1MEN1KMT2ANLRP3ANPEP

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 79 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423009-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES Bayer CropScience AG (DE) 2004-06-02 EP claimed
EP-1351571-A2 SELECTIVE HERBICIDES BASED UPON 2,6-DISUBSTITUTED PYRIDINE DERIVATIVES Bayer CropScience AG (DE) 2003-10-15 EP claimed
WO-2003017766-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES BAYER CROPSCIENCE AG (DE) 2003-03-06 WO claimed
EP-1221848-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES Bayer Aktiengesellschaft (DE) 2002-07-17 EP claimed
WO-2001035740-A2 SELECTIVE HERBICIDES BASED UPON 2,6-DISUBSTITUTED PYRIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2001-05-25 WO claimed
WO-2001022819-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-05 WO claimed
CN-1078852-A The weed killer herbicide of control weeds in paddy field HOECHST AG (DE) 1993-12-01 CN claimed
EP-3052230-A1 METAL CONTAINING CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS Dow Corning Corporation (US) 2016-08-10 EP disclosed
WO-2015050583-A1 METAL CONTAINING CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS DOW CORNING CORPORATION (US) 2015-04-09 WO disclosed
WO-2015020689-A1 CATALYSTS, COMPOSITIONS CONTAINING THE CATALYSTS, AND METHODS FOR THE PREPARATION THEREOF DOW CORNING CORPORATION (US) 2015-02-12 WO disclosed
EP-2785454-A1 HYDROSILYLATION REACTION CATALYSTS AND CURABLE COMPOSITIONS AND METHODS FOR THEIR PREPARATION AND USE Dow Corning Corporation (US) 2014-10-08 EP disclosed
EP-2764052-A2 IRON(III) CONTAINING COMPLEX AND CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS Dow Corning Corporation (US) 2014-08-13 EP disclosed
EP-2764053-A1 IRON(II) CONTAINING COMPLEX AND CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS Dow Corning Corporation (US) 2014-08-13 EP disclosed
EP-0415641-B1 Substituted glutaramic acids and derivatives ROHM & HAAS (US) 1994-01-19 EP disclosed
EP-0302334-A2 (Thio)phosphoryloxyacetic acid amides BAYER AG (DE) 1989-02-08 EP disclosed
US-4659365-A Herbicidal 2-chloro-2'-fluoroalkoxyacetanilides MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1987-04-21 US disclosed
EP-0165227-A2 High concentration encapsulation by interfacial polycondensation MONSANTO COMPANY (US) 1985-12-18 EP disclosed
EP-0148149-A2 High concentration encapsulation by interfacial polycondensation Monsanto Company (US) 1985-07-10 EP disclosed
EP-0148169-A2 High concentration encapsulation of water soluble-materials Monsanto Company (US) 1985-07-10 EP disclosed
EP-0017409-B1 ENCAPSULATION BY INTERFACIAL POLYCONDENSATION MONSANTO COMPANY (US) 1983-03-16 EP disclosed