SCHEMBL7498643

SCHEMBL7498643

CNC(=O)C(=NOC)c1ccccc1C(C)ON=CC(=NOC)c1ccc(OC)cc1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
CPS1 P31327 5/20 0.34
LMNA P02545 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HPGD P15428 3/20 0.34
GAA P10253 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPT P10636 3/20 0.33
HDAC1 Q13547 2/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MTNR1A P48039 1/20 0.31
CYP1A2 P05177 1/20 0.31
PGR P06401 1/20 0.31
CYP3A4 P08684 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
AR P10275 1/20 0.31
CHRM1 P11229 1/20 0.31

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
SCHEMBL7504773 0.92 LMNA (0.36) CPS1LMNAMEN1KMT2AHIF1A
SCHEMBL7500247 0.91
SCHEMBL7504420 0.91 HIF1A (0.38) ALDH1A1CPS1LMNAMEN1KMT2A
SCHEMBL7545134 0.90 KAT6A (0.34) LMNAHIF1A
SCHEMBL7542494 0.86 NPC1 (0.30) KMT2ANPC1RAB9A
SCHEMBL7501826 0.83 HIF1A (0.34) ALDH1A1LMNAMAPTHTTNPC1
SCHEMBL7502694 0.83 HIF1A (0.42) CPS1LMNAHIF1A
SCHEMBL6704054 0.83 HIF1A (0.36) ALDH1A1HIF1A
SCHEMBL7492778 0.82 HIF1A (0.36) HIF1A
SCHEMBL7784487 0.81 RECQL (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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