SCHEMBL583575

SCHEMBL583575

CCOC(=O)C(C(C)=O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.68
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
TSHR P16473 2/20 0.50
PIN1 Q13526 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
SRC P12931 1/20 0.47
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 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
SCHEMBL28365013 0.98 MMP8 (0.66) MMP8KMT2AMEN1NPC1CA12
SCHEMBL266419 0.90 MMP8 (0.74) MMP8KMT2AMEN1NPC1CA12
SCHEMBL28674585 0.89 MMP8 (0.72) MMP8KMT2AMEN1NPC1CA12
SCHEMBL31069943 0.89 MMP8 (0.72) MMP8KMT2AMEN1NPC1CA12
SCHEMBL1275691 0.87 MMP8 (0.70) MMP8KMT2AMEN1NPC1CA12
SCHEMBL15024699 0.86 ALDH1A1 (0.53) MMP8SMN1; SMN2SRC
SCHEMBL6959479 0.85 MMP8 (0.68) MMP8KMT2AMEN1NPC1CA12
SCHEMBL28464077 0.85 MMP8 (0.50) MMP8KMT2AMEN1NPC1CA12
SCHEMBL28474562 0.85 MMP8 (0.73) MMP8KMT2AMEN1NPC1CA12
Hydrochloric Acid SCHEMBL10677191 0.85 MMP8 (0.68) MMP8KMT2AMEN1NPC1CA12

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 243 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115068619-B Preparation method of photo-thermal dual-response composite carrier, prepared composite carrier and application of composite carrier 北京化工大学 2024-01-30 CN claimed
CN-115605036-A Light emitting device, display panel, manufacturing method of display panel and display device 京东方科技集团股份有限公司(CN) 2023-01-13 CN claimed
CN-112225721-B Acid-responsive near-infrared lysosome organic small-molecule fluorescent probe and preparation method and application thereof 复旦大学 2021-09-17 CN claimed
CN-112225721-A Acid-responsive near-infrared lysosome organic small-molecule fluorescent probe and preparation method and application thereof 复旦大学 2021-01-15 CN claimed
CN-210058251-U Production device of ethyl phenylacetate 辽宁先达农业科学有限公司 2020-02-14 CN claimed
EP-2308829-B1 A PROCESS FOR PREPARING R-BETA-AMINO PHENYLBUTYRIC ACID DERIVATIVES JIANGSU HENGRUI MEDICINE CO (CN) 2017-06-14 EP claimed
US-20160152825-A1 PROCESS FOR PRODUCING COMPOSITES EVONIK DEGUSSA GMBH (DE) 2016-06-02 US claimed
EP-3026072-A1 Method for the preparation of composites Evonik Degussa GmbH (DE) 2016-06-01 EP claimed
US-8580997-B2 Process for preparing R-beta-amino phenylbutyric acid derivatives JIANGSU HENGRUI MEDICINE CO. LTD. (CN) 2013-11-12 US claimed
US-20110130587-A1 PROCESS FOR PREPARING R-BETA-AMINO PHENYLBUTYRIC ACID DERIVATIVES JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2011-06-02 US claimed
EP-2308829-A1 A PROCESS FOR PREPARING R-BETA-AMINO PHENYLBUTYRIC ACID DERIVATIVES Jiangsu Hengrui Medicine Co., Ltd. (CN) 2011-04-13 EP claimed
JP-7101946-A None JP disclosed
CN-115068619-B Preparation method of photo-thermal dual-response composite carrier, prepared composite carrier and application of composite carrier 北京化工大学 2024-01-30 CN disclosed
US-11884837-B2 Scratch and mar resistant automotive coatings BASF COATINGS GMBH (DE) 2024-01-30 US disclosed
US-20230219978-A1 COMPOUND HAVING MACROCYCLIC STRUCTURE AND USE THEREOF SCINNOHUB PHARMACEUTICAL CO., LTD (CN) 2023-07-13 US disclosed
US-4007180-A POLYESTERS HOECHST AKTIENGESELLSCHAFT (DT) 1977-02-08 US disclosed
US-4005215-A DIURETIC BAYER AKTIENGESELLSCHAFT (DT) 1977-01-25 US disclosed
US-4000122-A BACTERICIDES AMERICAN HOME PRODUCTS CORPORATION (US) 1976-12-28 US disclosed
US-3978077-A DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (GB) 1976-08-31 US disclosed
US-3957814-A DIURETICS, SALURETICS, HYPOTENSIVE AGENTS, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-05-18 US 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 (2 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-20230219978-A1 COMPOUND HAVING MACROCYCLIC STRUCTURE AND USE THEREOF BTK, SRC, YES1 MMP8 3859/4885KMT2A 1866/4885MEN1 306/4885
US-20110130587-A1 PROCESS FOR PREPARING R-BETA-AMINO PHENYLBUTYRIC ACID DERIVATIVES ALAD, DAO, DDO MMP8 4805/4885KMT2A 3270/4885MEN1 4807/4885

“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.