SCHEMBL7744866

SCHEMBL7744866

CO/C=C(\C(=O)OC)c1ccccc1CO/N=C(C)/C(=N\OC)c1ccc(OCC(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.42
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
XBP1 P17861 1/20 0.35
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL7744870 1.00 HIF1A (0.42) HIF1ALMNAGAAHTTPOLB
SCHEMBL828229 0.87 HIF1A (0.47) HIF1A
SCHEMBL828228 0.87 HIF1A (0.47) HIF1A
SCHEMBL7875524 0.86 HIF1A (0.42) HIF1AMAPTALDH1A1
SCHEMBL17949973 0.86 HIF1A (0.42) HIF1AGAA
SCHEMBL7875521 0.86 HIF1A (0.42) HIF1AMAPTALDH1A1
SCHEMBL17949970 0.86 HIF1A (0.47) HIF1A
SCHEMBL7744887 0.85 HIF1A (0.41) HIF1AMAPTALDH1A1
SCHEMBL7744885 0.85 HIF1A (0.41) HIF1AMAPTALDH1A1
SCHEMBL7863544 0.85 HIF1A (0.40) 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 4 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
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