SCHEMBL7466202

SCHEMBL7466202

CCON=C(C(C)=NOCc1ccccc1N(C)C(=O)C=NOC)c1ccc(Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPK14 Q16539 1/20 0.33
MAOB P27338 4/20 0.33
CYP1A1 P04798 3/20 0.33
CYP1B1 Q16678 3/20 0.33
LIPE Q05469 3/20 0.32
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
EPHX2 P34913 1/20 0.31
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
MAOA P21397 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL7467425 0.93 MAOB (0.42) MAOBCYP1A1CYP1B1PPARGMAOA
SCHEMBL7464103 0.90 UTS2R (0.33) MEN1KMT2AMAOB
SCHEMBL6697614 0.88 MEN1 (0.39) MEN1KMT2AMAPK14MAOBLIPE
SCHEMBL7467535 0.88 MAOB (0.46) KMT2AMAOBEPHX2MAOA
SCHEMBL7470378 0.88 FFAR1 (0.34) PPARGPPARA
SCHEMBL8398044 0.78 FFAR1 (0.42) MAOBCYP1A1CYP1B1LIPEPPARG
SCHEMBL7545346 0.78 MAPK14 (0.37) MEN1KMT2AMAPK14MAOBLIPE
SCHEMBL7492706 0.77 HIF1A (0.42) MEN1KMT2AMAPK14MAOBEPHX2
SCHEMBL7470567 0.76 HIF1A (0.38) MEN1KMT2AMAPK14MAOBCYP1A1
SCHEMBL7470560 0.76 HIF1A (0.38) MEN1KMT2AMAPK14MAOBCYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0865424-B1 PESTICIDES BAYER AG (DE) 2002-09-18 EP disclosed
US-6420423-B1 PESTICIDE FOR USE ON CEREALS, BEETS, FRUITS, BERRIES, AND BEANS; KILLS MITES, INSECTS, TERMITES, LICE, FLEAS, AND FUNGUS; TOLERATED WELL BE ANIMALS, PLANTS, AND FISH BAYER AKTIENGESELLSCHAFT (DE) 2002-07-16 US disclosed
EP-1207152-A2 Pesticides Bayer Aktiengesellschaft (DE) 2002-05-22 EP disclosed
US-5985921-A OXIDATION AND HYDROGENATION OF COMPOUNDS TO FORM INSECTICIDES AS AGROCHEMICALS NOVARTIS CORPORATION (US) 1999-11-16 US disclosed
EP-0865424-A1 PESTICIDES Novartis AG (CH) 1998-09-23 EP disclosed
WO-1997020809-A1 PESTICIDES NOVARTIS AG (CH) 1997-06-12 WO disclosed