SCHEMBL29647890

SCHEMBL29647890

COC(=O)/C(=C/O)c1ccccc1COc1cccc(C(F)(F)F)n1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.40
TAS2R14 Q9NYV8 1/20 0.37
P2RX7 Q99572 1/20 0.36
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
TRPV1 Q8NER1 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
SCHEMBL7786380 1.00 HIF1A (0.40) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
SCHEMBL7786379 1.00 HIF1A (0.40) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
SCHEMBL7783632 0.93 HIF1A (0.41) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
SCHEMBL5369743 0.93 HIF1A (0.41) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
Picoxystrobin SCHEMBL18977 0.91 HIF1A (0.39) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
Picoxystrobin SCHEMBL675260 0.91 HIF1A (0.39) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
Picoxystrobin SCHEMBL29377786 0.91 HIF1A (0.39) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
SCHEMBL12704698 0.90 HIF1A (0.39) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
Picoxystrobin SCHEMBL17701174 0.90 HIF1A (0.39) HIF1ATAS2R14P2RX7HCRTR1HCRTR2
SCHEMBL31287388 0.88 TAS2R14 (0.39) TAS2R14P2RX7HCRTR1HCRTR2MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108368047-B Picoxystrobin crystal form, preparation method and application thereof 江苏龙灯化学有限公司 2022-06-10 CN disclosed