SCHEMBL8024272

SCHEMBL8024272

Oc1cccc(C2CC(c3ccccc3)=NN2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.54
MAOB P27338 1/20 0.54
CA1 P00915 2/20 0.53
KIF11 P52732 1/20 0.48
CXCL12 P48061 1/20 0.46
HSP90AA1 P07900 2/20 0.44
HSP90AB1 P08238 2/20 0.44
ERBB2 P04626 1/20 0.44
BRAF P15056 2/20 0.43
KDR P35968 2/20 0.43
ACHE P22303 2/20 0.43
BCHE P06276 2/20 0.43
ROCK2 O75116 1/20 0.42
EGFR P00533 1/20 0.42
CSF1R P07333 1/20 0.42
PIM1 P11309 1/20 0.42
PRKACA P17612 1/20 0.42
MAPK1 P28482 1/20 0.42
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42

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
SCHEMBL9135199 0.91 MAOB (0.51) MAOAMAOBCA1KIF11CXCL12
SCHEMBL6268223 0.84 MAOA (0.57) MAOAMAOBCA1CXCL12HSP90AA1
SCHEMBL9135091 0.83 MAOA (0.61) MAOAMAOBCA1CXCL12HSP90AA1
SCHEMBL9134273 0.83 MAOA (0.54) MAOAMAOBCA1CXCL12HSP90AA1
SCHEMBL11568809 0.75 PIM1 (0.48) MAOAMAOBCA1KIF11CXCL12
SCHEMBL8023942 0.75 CA1 (0.42) CA1
SCHEMBL31574562 0.74 LMNA (0.49) MAOAMAOBCA1CXCL12HSP90AA1
SCHEMBL13292150 0.74 CA1 (0.57) MAOAMAOBCA1CXCL12HSP90AA1
SCHEMBL15425077 0.73 HSP90AA1 (0.70) MAOAMAOBCA1CXCL12HSP90AA1
SCHEMBL8870493 0.73 CHRNB4 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1113859-C Substituted cyclopropyl phenoxymethyl phenyl carbamates and their use as fungicides DOW INO CO LTD (US) 2003-07-09 CN disclosed
CN-1107049-C Benzyloxy substituted aromatics and their use as fungicides and insecticides DOW BENEFITING AGRICULTURE CO (US) 2003-04-30 CN disclosed
EP-0889024-B1 Benzyloxy substituted aromatics and their use as fungicides and insecticides ROHM & HAAS (US) 2000-09-13 EP disclosed
US-6114375-A FOR CONTROLLING PHYTOPATHOGENIC FUNGI; METHYL N-ALKOXY-N-(2-((SUBSTITUTED CYCLOPROPYL)PHENOXYMETHYL)PHENYL) CARBAMATE DERIVATIVES ROHM AND HAAS COMPANY (US) 2000-09-05 US disclosed
US-6022891-A Substituted cyclopropyl phenoxymethyl phenyl carbamates and their use as fungicides ROHM AND HAAS COMPANY (US) 2000-02-08 US disclosed
US-5945557-A PHENYL DERIVATIVES WHICH POSSESS A SUBSTITUTED CYCLOPROPYL MOIETY; USEFUL AGAINST POWDERY MILDEW, BLIGHT AND OTHER PLATN DISEASES; INSECTICIDES AGAINST SOUTHERN ARMYWORM, MEXICAN BEAN BEETLE AND SPIDER MITES, FOR EXAMPLE ROHM AND HAAS COMPANY (US) 1999-08-31 US disclosed
CN-1226552-A Substituted cyclopropyl phenoxymethyl phenyl carbamates and their use as fungicides ROHM & HAAS (US) 1999-08-25 CN disclosed
EP-0924197-A1 Substituted cyclopropyl phenoxymethyl phenyl carbamates and their use as fungicides ROHM AND HAAS COMPANY (US) 1999-06-23 EP disclosed
CN-1204637-A Benzyloxy substituted aromatics and their use as fungicides and insecticides ROHM & HAAS (US) 1999-01-13 CN disclosed
EP-0889024-A1 Benzyloxy substituted aromatics and their use as fungicides and insecticides ROHM AND HAAS COMPANY (US) 1999-01-07 EP disclosed