SCHEMBL7500240

SCHEMBL7500240

CNC(=O)C(=NOC)c1ccccc1CON=C(C)C(=NOC)c1ccc(C)cc1F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.40
PTGS2 P35354 1/20 0.33
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
PARP14 Q460N5 1/20 0.31
PARP10 Q53GL7 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
FLT1 P17948 1/20 0.30
KDR P35968 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
SCHEMBL7492770 0.90 HIF1A (0.51) HIF1APTGS2IDO1TDO2PARP14
SCHEMBL7498636 0.90 HIF1A (0.42) HIF1AGAAPARP14PARP10ALDH1A1
SCHEMBL25603522 0.87 HIF1A (0.43) HIF1ATP53GAAKDM4EALDH1A1
SCHEMBL7504772 0.87 HIF1A (0.44) HIF1APARP14PARP10
SCHEMBL7542482 0.86 HIF1A (0.40) HIF1APTGS2GAAKDM4ELMNA
SCHEMBL7545129 0.86 HIF1A (0.43) HIF1APARP14PARP10
SCHEMBL7171770 0.85 HIF1A (0.43) HIF1APTGS2KDM4EALDH1A1LMNA
SCHEMBL7171768 0.85 HIF1A (0.43) HIF1APTGS2KDM4EALDH1A1LMNA
SCHEMBL13148667 0.83 HIF1A (0.46) HIF1APTGS2ALDH1A1LMNA
SCHEMBL828432 0.83 HIF1A (0.44) HIF1ATP53GAALMNARAB9A

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