SCHEMBL31121799

SCHEMBL31121799

CC(C)=CCc1c(O)ccc2c1O[C@H]1c3ccc4occc4c3OC[C@@H]21

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 5/20 0.60
▸ HSD17B1 P14061 1/20 0.49
▸ HSP90AA1 P07900 1/20 0.43
▸ TYR P14679 1/20 0.40
▸ PTGS1 P23219 1/20 0.40

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
SCHEMBL31121800 1.00 PTPN1 (0.60) PTPN1HSD17B1HSP90AA1TYRPTGS1
Erybraedin A SCHEMBL29572007 0.87 PTPN1 (0.76) PTPN1HSD17B1HSP90AA1TYRPTGS1
Phaseollidin SCHEMBL1545850 0.77 PTPN1 (0.77) PTPN1HSD17B1
Phaseollidin SCHEMBL29349654 0.77 PTPN1 (0.77) PTPN1HSD17B1
Erybraedin C SCHEMBL29572548 0.76 PTPN1 (0.77) PTPN1HSD17B1HSP90AA1
SCHEMBL29572116 0.76 PTPN1 (0.88) PTPN1HSD17B1HSP90AA1TYR
Erybreadin B SCHEMBL31237953 0.74 PTPN1 (1.00) PTPN1HSD17B1HSP90AA1
Erybreadin B SCHEMBL29571677 0.74 PTPN1 (1.00) PTPN1HSD17B1HSP90AA1
Erybreadin C SCHEMBL31237899 0.74 PTPN1 (1.00) PTPN1HSD17B1HSP90AA1
Licoagrocarpin SCHEMBL30999862 0.72 PTPN1 (0.78) PTPN1HSD17B1HSP90AA1TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4702149-A1 PLANTS PRODUCING PROTEINS FOR PEST CONTROL Univerza V Ljubljani (SI) 2026-03-04 — — EP disclosed
WO-2024223674-A1 PLANTS PRODUCING PROTEINS FOR PEST CONTROL UNIVERZA V LJUBLJANI (SI) 2024-10-31 — — WO disclosed
US-12049637-B2 Bio-pesticides for controlling plant pests KMETIJSKI INSTITUT SLOVENIJE (SI) 2024-07-30 — — US disclosed
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