SCHEMBL29425865

SCHEMBL29425865

O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](O[C@@H]3OC=C(C(=O)O)[C@H]4CC=C(CO)[C@@H]34)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 7/20 0.49
▸ ELANE P08246 1/20 0.45
▸ PTPN2 P17706 1/20 0.44
▸ PTPN11 Q06124 1/20 0.44
▸ PRKCA P17252 2/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ CA12 O43570 1/20 0.42
▸ TYR P14679 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ CA7 P43166 1/20 0.42

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
SCHEMBL29425919 0.97 PTPN1 (0.52) PTPN1ELANEPTPN2PTPN11CYP3A4
6'-O-P-Coumaroylgenipin Gentiobioside SCHEMBL29689589 0.92 ELANE (0.53) PTPN1ELANE
SCHEMBL29426143 0.89 PRKCA (0.52) PTPN1ELANEPRKCACYP19A1
Tarenninoside E SCHEMBL29426088 0.83 PTPN1 (0.46) PTPN1ELANEPTPN2PTPN11PRKCA
Tarenninoside D SCHEMBL29426111 0.78 PRKCA (0.46) PTPN1ELANEPRKCACYP19A1CA12
Geniposidic Acid SCHEMBL227010 0.78 PTPN1 (0.70) PTPN1PTPN2PTPN11
SCHEMBL29426041 0.77 HSP90AA1 (0.46) ELANEPRKCACYP19A1CYP3A4CA12
Genipin Gentiobioside SCHEMBL28007135 0.75 PTPN1 (0.64) PTPN1
SCHEMBL29425910 0.75 PRKCA (0.49) ELANEPRKCACYP19A1CYP3A4CA12
SCHEMBL31179879 0.73 HSP90AA1 (0.55) ELANEPRKCACYP3A4CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4702037-A1 METHOD OF PRODUCING IRIDOIDS Nicoventures Trading Limited (GB) 2026-03-04 — — EP disclosed
WO-2024224085-A1 METHOD OF PRODUCING IRIDOIDS Nicoventures Trading Limited (GB) 2024-10-31 — — WO disclosed
EP-3592432-B2 GARDENIA EXTRACT USED FOR COLORING KERATIN FIBERS FABRE PIERRE DERMO COSMETIQUE (FR) 2024-07-17 — — EP disclosed
CN-115728404-A Lanqin oral liquid contrast extract and preparation method and application thereof 扬子江药业集团有限公司 2023-03-03 — — CN disclosed
EP-3409766-B1 AN ESTERASE THAT IS CAPABLE OF CONVERTING IRIDOIDS AND SECO-IRIDOIDS N ZYME BIOTEC GMBH (DE) 2022-03-09 — — EP disclosed
US-11266593-B2 Gardenia extract for dyeing keratin fibres PIERRE FABRE DERMO-COSMETIQUE (FR) 2022-03-08 — — US disclosed
Send feedback