SCHEMBL7751835

SCHEMBL7751835

CCO/C(=N/OC(C)c1ccnc2ccccc12)c1ccccc1/C(=N\OC)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 2/20 0.34
CYP1A2 P05177 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CYP2D6 P10635 3/20 0.33
MAPT P10636 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 2/20 0.32
GLA P06280 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 4/20 0.32
RAB9A P51151 3/20 0.32
NPC1 O15118 2/20 0.32
CASP3 P42574 2/20 0.32
SENP8 Q96LD8 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
SENP6 Q9GZR1 2/20 0.32
MEN1 O00255 2/20 0.32
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
ELANE P08246 1/20 0.32

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
SCHEMBL7753073 0.73 TSHR (0.42) CYP1A2MAPTKDM4EKMT2ANPC1
SCHEMBL7752765 0.70 TSHR (0.38) PRNPMAPTKMT2ANPC1MEN1
SCHEMBL7752186 0.68 L3MBTL1 (0.38) MAPTL3MBTL1ALDH1A1
SCHEMBL6176426 0.68 KDM4E (0.43) PRNPCYP1A2CYP2D6MAPTL3MBTL1
SCHEMBL8020206 0.66 HCRTR1 (0.51) MAPTL3MBTL1KDM4EGLAKMT2A
SCHEMBL8020209 0.66 HCRTR1 (0.51) MAPTL3MBTL1KDM4EGLAKMT2A
SCHEMBL13631854 0.64 NCF1 (0.44) CYP1A2CYP2D6MAPTKDM4ERAB9A
SCHEMBL7751834 0.64 ALDH1A1 (0.32) CYP1A2MAPTL3MBTL1KDM4EPOLB
SCHEMBL7747800 0.64 ALDH1A1 (0.32) CYP1A2MAPTL3MBTL1KDM4EPOLB
SCHEMBL17758656 0.64 CYP1A2 (0.41) CYP1A2CYP2D6MAPTPOLBKMT2A

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-1070052-A1 FUNGICIDE COMPOSITIONS COMPRISING A HYDROXIMIC OR HYDRAZONIC GROUP AVENTIS CROPSCIENCE S.A. (FR) 2001-01-24 EP disclosed
WO-1999051579-A1 FUNGICIDE COMPOSITIONS COMPRISING A HYDROXIMIC OR HYDRAZONIC GROUP AVENTIS CROPSCIENCE S.A. (FR) 1999-10-14 WO disclosed