SCHEMBL759593

SCHEMBL759593

Cn1oc(=O)nc1N(CCF)Cc1ccc(Cl)nc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL229418 0.87 MAPT (0.35) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL231801 0.85 MEN1 (0.34) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL230489 0.85 ALDH1A1 (0.35) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL231494 0.82 GAA (0.39) ALDH1A1GAAMAPTKMT2AL3MBTL1
SCHEMBL229978 0.79 FGFR1 (0.36) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL231942 0.77 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AATM
SCHEMBL230686 0.71 CHRNA1 (0.32) ALDH1A1GAAMAPT
SCHEMBL28773340 0.71 ALDH1A1 (0.35) ALDH1A1L3MBTL1LMNA
SCHEMBL120449 0.71 CHRNA1 (0.32) ALDH1A1GAAMAPT
SCHEMBL2892516 0.71 CHRNA1 (0.34) GAAMAPTL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2587922-A1 IMPROVED INSECTICIDAL COMPOSITIONS COMPRISING CYCLIC CARBONYLAMIDINES Bayer Intellectual Property GmbH (DE) 2013-05-08 EP disclosed
WO-2012000902-A1 IMPROVED INSECTICIDAL COMPOSITIONS COMPRISING CYCLIC CARBONYLAMIDINES BAYER CROPSCIENCE AG (DE) 2012-01-05 WO disclosed