SCHEMBL2210131

SCHEMBL2210131

O=C(Cl)c1ccccc1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.53
POLB P06746 1/20 0.49
ALDH1A1 P00352 4/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NR1H2 P55055 2/20 0.44
NR1H3 Q13133 2/20 0.44
CYP3A4 P08684 1/20 0.44
NFKB1 P19838 1/20 0.44
PMP22 Q01453 1/20 0.44
SCN2A Q99250 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
CASP1 P29466 1/20 0.42
ALOX15 P16050 1/20 0.42
GAA P10253 1/20 0.42
PIM3 Q86V86 1/20 0.41
HIPK4 Q8NE63 1/20 0.41

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
SCHEMBL3032069 0.84 ALDH1A1 (0.41) APEX1POLBALDH1A1MEN1KMT2A
N-Phthaloylanthranilic Acid SCHEMBL29549628 0.83 APEX1 (0.71) APEX1POLBALDH1A1NR1H2NR1H3
N-Phthaloylanthranilic Acid SCHEMBL481284 0.83 APEX1 (0.71) APEX1POLBALDH1A1NR1H2NR1H3
SCHEMBL9654610 0.81 APEX1 (0.53) APEX1POLBALDH1A1MEN1KMT2A
SCHEMBL30423190 0.81 APEX1 (0.53) APEX1POLBALDH1A1NR1H2NR1H3
SCHEMBL11817098 0.81 APEX1 (0.53) APEX1POLBALDH1A1NR1H2NR1H3
SCHEMBL3036292 0.79 ALDH1A1 (0.64) ALDH1A1ALOX15GAASMN1; SMN2HSP90AA1
SCHEMBL729027 0.77 APEX1 (0.49) APEX1POLBALDH1A1NR1H2NR1H3
SCHEMBL10505136 0.77 APEX1 (0.49) APEX1POLBALDH1A1NR1H2NR1H3
SCHEMBL4649466 0.77 POLB (0.65) POLBALDH1A1MEN1KMT2ANR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7981686-B2 Indicator for assessing body odor, process for producing the same, body odor assessment method, method of assessing efficaciousness of deodorant and kit for conveniently assessing body odor KAO CORPORATION (JP) 2011-07-19 US disclosed
US-20100184122-A1 INDICATOR FOR ASSESSING BODY ODOR, PROCESS FOR PRODUCING THE SAME, BODY ODOR ASSESSMENT METHOD, METHOD OF ASSESSING EFFICACIOUSNESS OF DEODORANT AND KIT FOR CONVENIENTLY ASSESSING BODY ODOR KAO CORPORATION (JP) 2010-07-22 US disclosed
US-20060160240-A1 Indicator for assessing body odor, process for producing the same, body odor assessment method, method of assessing efficaciousness of deodorant and kit for conveniently assessing body odor KAO CORPORATION (JP) 2006-07-20 US disclosed
EP-1553411-A1 INDICATOR FOR ASSESSING BODY ODOR, PROCESS FOR PRODUCING THE SAME, BODY ODOR ASSESSMENT METHOD, METHOD OF ASSESSING EFFICACIOUSNESS OF DEODORANT AND KIT FOR CONVENIENTLY ASSESING BODY ODOR Kao Corporation (JP) 2005-07-13 EP disclosed