SCHEMBL7168697

SCHEMBL7168697

CO/C=C(/C(=O)OC)c1ccccc1COc1cccc(Oc2ncccn2)c1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.48
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL7168699 1.00 HIF1A (0.48) HIF1AMEN1KMT2AGAAMAPT
SCHEMBL7171910 0.89 HIF1A (0.54) HIF1A
SCHEMBL7171914 0.89 HIF1A (0.54) HIF1A
SCHEMBL9894785 0.88 HIF1A (0.48) HIF1ANPC1RAB9A
SCHEMBL9894787 0.88 HIF1A (0.48) HIF1ANPC1RAB9A
SCHEMBL9894789 0.88 HIF1A (0.48) HIF1ANPC1RAB9A
SCHEMBL9894618 0.85 HIF1A (0.56) HIF1AMEN1KMT2AHTT
SCHEMBL9894620 0.85 HIF1A (0.56) HIF1AMEN1KMT2AHTT
SCHEMBL9894617 0.85 HIF1A (0.56) HIF1AMEN1KMT2AHTT
SCHEMBL9895099 0.85 HIF1A (0.66) 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-6653258-B1 Pyridinyl-substituted- methyl 3-methoxy-2-phenylacrylate derivatives; agricultural miticides and nematocides SYNGENTA LIMITED (GB) 2003-11-25 US disclosed
US-5438059-A Derivatives of propenoic acid; stereoisomers; applying to plants ZENECA LIMITED (GB) 1995-08-01 US disclosed
US-5021581-A Fungicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-04 US disclosed
EP-0278595-A2 Fungicides ZENECA LIMITED (GB) 1988-08-17 EP disclosed