SCHEMBL6253552

SCHEMBL6253552

O=C(Nc1ccccc1-c1ccc(CC=NOCC=C(Cl)Cl)cc1)c1cccnc1Cl

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.58
ALDH1A1 P00352 4/20 0.44
HPGD P15428 2/20 0.44
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
HTT P42858 1/20 0.39
NPC1 O15118 3/20 0.36
ATM Q13315 2/20 0.36
RAB9A P51151 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL3025988 0.82 TDP1 (0.58) TDP1ALDH1A1HPGDGAAL3MBTL1
SCHEMBL3025986 0.82 TDP1 (0.58) TDP1ALDH1A1HPGDGAAL3MBTL1
SCHEMBL13215983 0.78 TDP1 (0.62) TDP1ALDH1A1HPGDGAAL3MBTL1
SCHEMBL14578136 0.76 TDP1 (0.65) TDP1ALDH1A1HPGDGAAL3MBTL1
Boscalid SCHEMBL29488452 0.75 TDP1 (1.00) TDP1ALDH1A1HPGDGAAL3MBTL1
Boscalid SCHEMBL29368300 0.75 TDP1 (1.00) TDP1ALDH1A1HPGDGAAL3MBTL1
Boscalid SCHEMBL18517 0.75 TDP1 (1.00) TDP1ALDH1A1HPGDGAAL3MBTL1
SCHEMBL8074225 0.75 TDP1 (0.85) TDP1ALDH1A1HPGDGAAL3MBTL1
SCHEMBL13215940 0.75 TDP1 (0.60) TDP1ALDH1A1HPGDGAAL3MBTL1
SCHEMBL14578361 0.75 TDP1 (0.62) TDP1ALDH1A1HPGDGAAL3MBTL1

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-1572663-A1 BIPHENYLCARBOXAMIDES Bayer CropScience AG (DE) 2005-09-14 EP disclosed
WO-2004054982-A1 BIPHENYLCARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2004-07-01 WO disclosed