SCHEMBL2008273

SCHEMBL2008273

COC(=O)c1ncccc1NCC(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
BRD4 O60885 1/20 0.47
METAP2 P50579 3/20 0.43
SCD O00767 5/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 1/20 0.41
BDKRB1 P46663 1/20 0.41
ACLY P53396 1/20 0.39
POLB P06746 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL2013556 0.84 KDM4E (0.46) L3MBTL1METAP2SCDKDM4EALDH1A1
SCHEMBL2372675 0.80 L3MBTL1 (0.49) L3MBTL1BRD4SCDKDM4EALDH1A1
SCHEMBL5256090 0.78 L3MBTL1 (0.50) L3MBTL1BRD4KDM4EALDH1A1ACLY
SCHEMBL5258001 0.78 L3MBTL1 (0.50) L3MBTL1BRD4KDM4EALDH1A1ACLY
SCHEMBL1894761 0.77 L3MBTL1 (0.58) L3MBTL1BRD4KDM4EALDH1A1ACLY
SCHEMBL8884667 0.76 KDM4E (0.62) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL1173445 0.75 L3MBTL1 (0.50) L3MBTL1METAP2ALDH1A1KMT2A
SCHEMBL2012467 0.75 SCD (0.45) SCDKDM4EPOLBKMT2A
SCHEMBL28751799 0.74 BRD4 (0.56) L3MBTL1BRD4KDM4EALDH1A1POLB
SCHEMBL2346222 0.74 L3MBTL1 (0.55) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011064188-A1 INSECTICIDAL METHODS USING NITROGEN-CONTAINING HETEROAROMATIC COMPOUNDS BASF SE (DE) 2011-06-03 WO disclosed