SCHEMBL47336

SCHEMBL47336

NCNC(=O)N1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 2/20 0.44
EPHX2 P34913 1/20 0.43
HTT P42858 2/20 0.42
ATM Q13315 1/20 0.39
TPSAB1 Q15661 4/20 0.38
TPSD1 Q9BZJ3 4/20 0.38
TPSG1 Q9NRR2 4/20 0.38
LMNA P02545 1/20 0.38
HSD11B1 P28845 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL47339 0.98 KMT2A (0.46) KMT2AALDH1A1EPHX2HTTLMNA
SCHEMBL47346 0.80 HTT (0.66) KMT2AHTT
SCHEMBL7804748 0.78 KMT2A (0.50) KMT2AALDH1A1EPHX2HTTATM
SCHEMBL14282244 0.78 KMT2A (0.50) KMT2AALDH1A1EPHX2HTTHSD11B1
SCHEMBL14941550 0.76 KMT2A (0.48) KMT2AALDH1A1EPHX2HTTHSD11B1
SCHEMBL5522397 0.76 KMT2A (0.48) KMT2AALDH1A1EPHX2HTTATM
SCHEMBL965286 0.76 KMT2A (0.82) KMT2AALDH1A1EPHX2HTTLMNA
SCHEMBL9092175 0.76 KMT2A (0.48) KMT2AALDH1A1EPHX2HTTATM
SCHEMBL17273967 0.76 EPHX2 (0.47) KMT2AALDH1A1EPHX2HTTTPSAB1
SCHEMBL14037284 0.76 TPSAB1 (0.60) EPHX2HTTTPSAB1TPSD1TPSG1

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-2582696-B1 5-ARYL ISOXAZOLINES FOR CONTROLLING PESTS NOVARTIS AG (CH) 2014-10-22 EP disclosed
WO-2011157748-A1 5-ARYL ISOXAZOLINES FOR CONTROLLING PESTS NOVARTIS AG (CH) 2011-12-22 WO disclosed