SCHEMBL2003894

SCHEMBL2003894

CC(C)(C)C1CC(c2nc(C3=NOC(c4ccccc4[N+](=O)[O-])C3)cs2)CCN1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FAAH O00519 20/20 0.48

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
SCHEMBL2003898 1.00 FAAH (0.48) FAAH
SCHEMBL696899 0.88 FAAH (0.51) FAAH
SCHEMBL696867 0.87 FAAH (0.49) FAAH
SCHEMBL2457457 0.86 FAAH (0.59) FAAH
SCHEMBL2457454 0.86 FAAH (0.59) FAAH
SCHEMBL697105 0.86 FAAH (0.49) FAAH
SCHEMBL1991159 0.85 FAAH (0.49) FAAH
SCHEMBL2729660 0.84 FAAH (0.49) FAAH
SCHEMBL2003896 0.83 FAAH (0.58) FAAH
SCHEMBL17074510 0.82 FAAH (0.47) FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516426-B1 BIS(DIFLUORMETHYL)PYRAZOLES USED AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2015-09-16 EP disclosed
EP-2516426-A1 BIS(DIFLUORMETHYL)PYRAZOLES USED AS FUNGICIDES Bayer CropScience AG (DE) 2012-10-31 EP disclosed
WO-2011076699-A1 BIS(DIFLUORMETHYL)PYRAZOLES USED AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2011-06-30 WO disclosed