SCHEMBL6238073

SCHEMBL6238073

CCc1cccc(CC)c1N(C(=O)c1ccno1)C(C)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
PLA2G1B P04054 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 3/20 0.38
HSD17B10 Q99714 3/20 0.38
NPC1 O15118 2/20 0.38
LMNA P02545 1/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 1/20 0.35
RORC P51449 3/20 0.35
ELANE P08246 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL394927 0.87 KMT2A (0.57) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL394928 0.87 KMT2A (0.57) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL11154441 0.77 KMT2A (0.47) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL7264107 0.74 KMT2A (0.45) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL18419940 0.74 KMT2A (0.45) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL8169798 0.74 MEN1 (0.46) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL6238075 0.71 HSD17B10 (0.37) KMT2AL3MBTL1HPGDHSD17B10NPC1
SCHEMBL11258075 0.70 TP53 (0.55) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL11149684 0.70 TP53 (0.55) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL14384723 0.67 MEN1 (0.57) KMT2AMEN1PLA2G1BHTTNPSR1

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-1513843-A1 PYRAZOLOPYRIMIDINES AND THE USE THEREOF FOR CONTROLLING HARMFUL ORGANISMS Bayer CropScience AG (DE) 2005-03-16 EP disclosed
WO-2004000844-A1 PYRAZOLOPYRIMIDINES AND THE USE THEREOF FOR CONTROLLING HARMFUL ORGANISMS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-12-31 WO disclosed