SCHEMBL17767386

SCHEMBL17767386

CC(C)C(=O)O[C@@H]1[C@@H](O)[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)O[C@H](CO)[C@H]1O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 5/20 0.46
▸ GAA P10253 4/20 0.41
▸ AMY2A P04746 4/20 0.41
▸ MGAM O43451 2/20 0.41
▸ AMY1A P0DUB6 1/20 0.41
▸ SI P14410 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ PDE4A P27815 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ MGAM2 Q2M2H8 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ TYR P14679 4/20 0.41
▸ LGALS3 P17931 1/20 0.40
▸ LGALS4 P56470 1/20 0.40
▸ MAPK1 P28482 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
SCHEMBL5181432 0.91 TYR (0.41) LGALS8GAAAMY2AALDH1A1TYR
SCHEMBL2237219 0.85 LGALS8 (0.49) LGALS8GAAAMY2AMGAMAMY1A
SCHEMBL17767394 0.85 LGALS8 (0.49) LGALS8TYR
SCHEMBL16328640 0.85 MAPK1 (0.41) LGALS8ALDH1A1MAPK1
SCHEMBL17767384 0.84 LGALS3 (0.50) LGALS8AMY1ATYRLGALS3LGALS4
SCHEMBL1816454 0.84 LGALS8 (0.49) LGALS8GAAAMY2AMGAMAMY1A
SCHEMBL4751806 0.84 MAPK1 (0.41) LGALS8GAAAMY2AMGAMAMY1A
SCHEMBL17767392 0.83 LGALS8 (0.56) LGALS8GAAAMY2AMGAMAMY1A
SCHEMBL12502058 0.83 LGALS8 (0.48) LGALS8GAAAMY2AMGAMAMY1A
SCHEMBL8468755 0.83 LGALS8 (0.52) LGALS8GAAAMY2AMGAMAMY1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117835831-A Flavor modulating composition 玉米产品开发公司 2024-04-05 — — CN disclosed
CN-115501172-A Gel formulations for topical drug delivery 丹麦技术大学 2022-12-23 — — CN disclosed
CN-107249570-B Gel formulations for topical drug delivery 丹麦技术大学 2022-08-09 — — CN disclosed
US-20210386669-A1 GEL FORMULATIONS FOR LOCAL DRUG RELEASE TECHNICAL UNIVERSITY OF DENMARK (DK) 2021-12-16 — — US disclosed
US-11065201-B2 Gel formulations for local drug release TECHNICAL UNIVERSITY OF DENMARK (DK) 2021-07-20 — — US disclosed
US-20180325819-A1 GEL FORMULATIONS FOR LOCAL DRUG RELEASE TECHNICAL UNIVERSITY OF DENMARK (DK) 2018-11-15 — — US disclosed
CN-107249570-A Gel formulations for topical drug delivery 丹麦技术大学 2017-10-13 — — CN disclosed
EP-3220887-A1 GEL FORMULATIONS FOR LOCAL DRUG RELEASE Technical University of Denmark (DK) 2017-09-27 — — EP disclosed
WO-2016079331-A1 GEL FORMULATIONS FOR ENHANCING THE EFFECT OF RADIOTHERAPY TECHNICAL UNIVERSITY OF DENMARK (DK) 2016-05-26 — — WO disclosed
WO-2016079332-A1 GEL FORMULATIONS FOR IMPROVING IMMUNOTHERAPY TECHNICAL UNIVERSITY OF DENMARK (DK) 2016-05-26 — — WO disclosed
WO-2016079330-A1 GEL FORMULATIONS FOR LOCAL DRUG RELEASE TECHNICAL UNIVERSITY OF DENMARK (DK) 2016-05-26 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11065201-B2 Gel formulations for local drug release TREH, GALE, SLC2A8 LGALS8 19/4885GAA 174/4885AMY2A 364/4885
US-20180325819-A1 GEL FORMULATIONS FOR LOCAL DRUG RELEASE TREH, GALE, SLC2A8 LGALS8 19/4885GAA 174/4885AMY2A 364/4885
US-20210386669-A1 GEL FORMULATIONS FOR LOCAL DRUG RELEASE TREH, GALE, SLC2A8 LGALS8 19/4885GAA 174/4885AMY2A 364/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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