SCHEMBL7498630

SCHEMBL7498630

CNC(=O)/C(=N/OC)c1ccccc1/C(ON)=C(C)/C(=N\OC)c1ccc(OC)cc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPS1 P31327 9/20 0.37
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
PARP14 Q460N5 1/20 0.34
PARP10 Q53GL7 1/20 0.34
LMNA P02545 4/20 0.33
HPGD P15428 4/20 0.33
CYP1A2 P05177 2/20 0.33
PGR P06401 2/20 0.33
SLC6A2 P23975 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP3A4 P08684 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
AR P10275 1/20 0.33
CHRM1 P11229 1/20 0.33
ALOX15 P16050 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
HIF1A Q16665 1/20 0.33
MTNR1A P48039 1/20 0.33

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
SCHEMBL7504767 0.91 PARP14 (0.36) CPS1PARP14PARP10LMNAHIF1A
SCHEMBL7504398 0.90 HIF1A (0.40) CPS1NPC1RAB9APARP14PARP10
SCHEMBL7500236 0.89 IDO1 (0.31) GAA
SCHEMBL7542473 0.83 RAB9A (0.35) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL7502685 0.81 HIF1A (0.44) CPS1PARP14PARP10LMNAHIF1A
SCHEMBL7501814 0.80 HIF1A (0.35) NPC1RAB9ALMNAHIF1AMAPT
SCHEMBL6703061 0.80 HIF1A (0.39) HIF1AMAPTGAA
SCHEMBL7492764 0.79 HIF1A (0.39) NPC1RAB9ALMNAHIF1AALDH1A1
SCHEMBL7498636 0.77 HIF1A (0.42) CPS1PARP14PARP10LMNAHPGD
SCHEMBL7740767 0.76 HIF1A (0.32) HIF1A

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