SCHEMBL6606589

SCHEMBL6606589

CCOC(=O)c1ccc(Cl)c(OCCC2(SC)N=NN=N2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 2/20 0.39
TDP1 Q9NUW8 2/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 2/20 0.36
USP2 O75604 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
POLB P06746 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 2/20 0.35
METTL3 Q86U44 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP1A2 P05177 1/20 0.34
CA12 O43570 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
SCHEMBL6604193 0.86 KDM4E (0.32) ALDH1A1HTTKDM4ETSHR
SCHEMBL6603934 0.86
SCHEMBL6608504 0.85 KMT2A (0.41) ALDH1A1MAPTHPGDCYP4F2CYP4A11
SCHEMBL588042 0.77 CYP4F2 (0.46) ALDH1A1CYP4F2CYP4A11KMT2AMEN1
SCHEMBL8417857 0.76 CYP4F2 (0.45) ALDH1A1MAPTHPGDCYP4F2CYP4A11
SCHEMBL587498 0.76 CYP4F2 (0.45) ALDH1A1MAPTCYP4F2CYP4A11KMT2A
SCHEMBL587118 0.76 CYP4F2 (0.51) ALDH1A1CYP4F2CYP4A11KMT2AMEN1
SCHEMBL3437219 0.76 CYP4F2 (0.45) ALDH1A1CYP4F2CYP4A11KMT2AMEN1
SCHEMBL588132 0.75 CYP4F2 (0.50) ALDH1A1CYP4F2CYP4A11KMT2AMEN1
SCHEMBL6604569 0.72 ALDH1A1 (0.38) ALDH1A1MAPTKMT2AMEN1LMNA

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-1476437-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES Bayer CropScience AG (DE) 2004-11-17 EP disclosed
WO-2003066607-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-08-14 WO disclosed