SCHEMBL17008170

SCHEMBL17008170

NC(=NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.52
CYP2C19 P33261 2/20 0.52
MAPT P10636 2/20 0.52
TSHR P16473 2/20 0.52
CYP3A4 P08684 1/20 0.52
PARP1 P09874 1/20 0.52
RECQL P46063 1/20 0.52
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPK1 P28482 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
GAA P10253 2/20 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
SCHEMBL6791698 0.90 POLB (0.49) POLBCYP2C19MAPTTSHRCYP3A4
SCHEMBL6649650 0.90 POLB (0.49) POLBCYP2C19MAPTTSHRCYP3A4
SCHEMBL17504830 0.84 MAPT (0.54) POLBCYP2C19MAPTTSHRCYP3A4
SCHEMBL828587 0.84 TPH1 (0.55) POLBCYP2C19MAPTTSHRCYP3A4
SCHEMBL15599673 0.84 MAPT (0.54) POLBCYP2C19MAPTTSHRCYP3A4
SCHEMBL27489015 0.82 TPH1 (0.53) POLBCYP2C19MAPTTSHRCYP3A4
Hydrochloric Acid SCHEMBL27319279 0.82 TPH1 (0.53) POLBCYP2C19MAPTTSHRCYP3A4
Hydrochloric Acid SCHEMBL27296270 0.82 TPH1 (0.53) POLBCYP2C19MAPTTSHRCYP3A4
SCHEMBL15320289 0.80 CYP2C19 (0.50) POLBCYP2C19MAPTTSHRCYP3A4
SCHEMBL15336489 0.80 CYP2C19 (0.50) POLBCYP2C19MAPTTSHRCYP3A4

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
WO-2015121802-A1 BENZOYLPHENYL-FORMAMIDINES HAVING A FUNGICIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND RELATIVE USE ISAGRO S.P.A. (IT) 2015-08-20 WO claimed
WO-2015121802-A1 BENZOYLPHENYL-FORMAMIDINES HAVING A FUNGICIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND RELATIVE USE ISAGRO S.P.A. (IT) 2015-08-20 WO disclosed
WO-2015121802-A1 BENZOYLPHENYL-FORMAMIDINES HAVING A FUNGICIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND RELATIVE USE ISAGRO S.P.A. (IT) 2015-08-20 WO disclosed