SCHEMBL678328

SCHEMBL678328

Cc1ccc(C(C(=O)CC2CCCCN2)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.47
SLC6A2 P23975 5/20 0.47
SLC6A4 P31645 4/20 0.47
CACNA2D1 P54289 1/20 0.46
CACNA1B Q00975 1/20 0.46
CACNB1 Q02641 1/20 0.46
POLB P06746 1/20 0.43
DHFR P00374 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43

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
SCHEMBL11806394 0.92 CACNA2D1 (0.51) SLC6A3SLC6A2SLC6A4CACNA2D1CACNA1B
SCHEMBL465948 0.91 CACNA2D1 (0.50) SLC6A3SLC6A2SLC6A4CACNA2D1CACNA1B
SCHEMBL465789 0.88 CACNA2D1 (0.46) SLC6A3SLC6A2SLC6A4CACNA2D1CACNA1B
SCHEMBL5193935 0.75 L3MBTL1 (0.41) POLB
SCHEMBL11448239 0.72 LTA4H (0.46) SLC6A3SLC6A2SLC6A4POLB
SCHEMBL5082818 0.72 CHRNA7 (0.49) CACNA2D1CACNA1BCACNB1POLB
SCHEMBL8493732 0.72 POLB (0.59) SLC6A3SLC6A2SLC6A4CACNA2D1CACNA1B
SCHEMBL18192367 0.72 CACNA2D1 (0.52) SLC6A3SLC6A2SLC6A4CACNA2D1CACNA1B
SCHEMBL7860033 0.71 POLB (0.54) CACNA2D1CACNA1BCACNB1POLB
SCHEMBL10679403 0.71 CYP2D6 (0.62) SLC6A3SLC6A2SLC6A4CACNA2D1CACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110268692-A1 Synergistic rodenticidal compositions BAYER CROPSCIENCE AG (DE) 2011-11-03 US disclosed
US-20100287815-A1 METHOD FOR CONTROLLING HARMFUL RODENTS IN AGRICULTURAL ENTERPRISES BAYER CROPSCIENCE AG (DE) 2010-11-18 US disclosed
EP-1389039-B1 METHOD FOR CONTROLLING HARMFUL RODENTS IN AGRICULTURAL ENTERPRISES BAYER CROPSCIENCE AG (DE) 2008-11-12 EP disclosed
US-7008632-B2 Combination of biological and chemical agents to combat rodents BAYER AKTIENGESELLSCHAFT (DE) 2006-03-07 US disclosed
US-20050181003-A1 Rodenticidal bait systems BAYER CROPSCIENCE AG (DE) 2005-08-18 US disclosed
US-20040247638-A1 Method for controlling harmful rodents in agricultural enterprises BAYER CROPSCIENCE AG (DE) 2004-12-09 US disclosed
US-20040028713-A1 Combination of biological and chemical agents to combat rodents JAKEL, THOMAS, DR. (DE) 2004-02-12 US disclosed
EP-1251740-A2 COMBINATION OF BIOLOGICAL AND CHEMICAL AGENTS TO COMBAT RODENTS Bayer Aktiengesellschaft (DE) 2002-10-30 EP disclosed
WO-2001052654-A2 COMBINATION OF BIOLOGICAL AND CHEMICAL AGENTS TO COMBAT RODENTS BAYER AKTIENGESELLSCHAFT (DE) 2001-07-26 WO disclosed
US-6036970-A POISONS FOR ANIMALS SUCH AS RODENTS BAYER AKTIENGESELLSCHAFT (DE) 2000-03-14 US disclosed
EP-0719498-B1 Rodenticidal foams BAYER AG (DE) 1999-05-26 EP disclosed
EP-0789998-B1 Rodenticidal foams BAYER AG (DE) 1998-05-06 EP disclosed
EP-0789998-A1 Rodenticidal foams BAYER AG (DE) 1997-08-20 EP disclosed
EP-0719498-A1 Rodenticidal foams BAYER AG (DE) 1996-07-03 EP disclosed
US-4011332-A RODENTICIDE BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-03-08 US disclosed