SCHEMBL28705673

SCHEMBL28705673

C=CC(=O)Oc1ccc(OC(C)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.59
LMNA P02545 3/20 0.59
MAPT P10636 3/20 0.53
POLB P06746 2/20 0.53
PKM P14618 1/20 0.53
ELANE P08246 2/20 0.52
KDM4E B2RXH2 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CYP3A4 P08684 2/20 0.52
TTR P02766 1/20 0.52
TP53 P04637 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HSD17B10 Q99714 1/20 0.50
GAA P10253 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HSP90AA1 P07900 1/20 0.48
GLA P06280 2/20 0.46
ESR1 P03372 1/20 0.44
PGR P06401 1/20 0.44

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
SCHEMBL15494723 0.94 HSD17B10 (0.59) THRBLMNAMAPTPOLBPKM
SCHEMBL29261849 0.91 ELANE (0.53) THRBLMNAMAPTPOLBPKM
SCHEMBL24171804 0.89 THRB (0.50) THRBLMNAMAPTPOLBPKM
SCHEMBL2587522 0.89 THRB (0.64) THRBLMNAMAPTPKMELANE
SCHEMBL5899677 0.88 THRB (0.49) THRBLMNAMAPTPOLBPKM
SCHEMBL19155399 0.84 CA12 (0.49) THRBLMNAMAPTPOLBKDM4E
SCHEMBL20342948 0.83 THRB (0.45) THRBLMNAMAPTPOLBPKM
SCHEMBL2583966 0.83 THRB (0.61) THRBLMNAMAPTPKMELANE
SCHEMBL898885 0.83 MAPT (0.57) THRBLMNAMAPTPOLBELANE
SCHEMBL269329 0.83 LMNA (0.80) LMNAMAPTPOLBPKMELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117177808-A Delivery particles with high core to wall ratio 恩盖普有限公司 2023-12-05 CN disclosed
CN-116490536-A Biodegradable delivery particles 恩盖普有限公司 2023-07-25 CN disclosed
CN-116490068-A Biodegradable delivery particles 恩盖普有限公司 2023-07-25 CN disclosed
CN-116471933-A Biodegradable delivery particles 恩盖普有限公司 2023-07-21 CN disclosed
CN-116472303-A Polyacrylate and poly (beta-ester) capsules with improved degradability 恩盖普有限公司 2023-07-21 CN disclosed
CN-116033963-A Benefit agent-containing delivery particles with high core-to-wall ratio 恩盖普有限公司 2023-04-28 CN disclosed
CN-109651253-B Phenylpropanoid ester derivative and application thereof as neuroprotective medicament 上海医药工业研究院 2022-03-25 CN disclosed