SCHEMBL3289816

SCHEMBL3289816

CCOC(=O)C(C)=CC(C)N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.44
CYP2D6 P10635 3/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2C9 P11712 2/20 0.41
NPSR1 Q6W5P4 2/20 0.39
ALDH1A1 P00352 6/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ALOX15 P16050 1/20 0.38
MAPT P10636 2/20 0.36
TRPA1 O75762 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
S1PR4 O95977 1/20 0.35
S1PR1 P21453 1/20 0.35
MAPK1 P28482 1/20 0.35
TSHR P16473 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL9113428 0.85 HCAR2 (0.36) CYP2D6CYP2C19CYP2C9ALDH1A1LMNA
SCHEMBL5076122 0.83 GLO1 (0.47) GLO1CYP2D6CYP2C19CYP2C9NPSR1
SCHEMBL5076118 0.83 GLO1 (0.47) GLO1CYP2D6CYP2C19CYP2C9NPSR1
SCHEMBL2820296 0.82 GLO1 (0.42) GLO1CYP2D6CYP2C19CYP2C9NPSR1
SCHEMBL1293247 0.82 ALDH1A1 (0.47) CYP2D6CYP2C19CYP2C9NPSR1ALDH1A1
SCHEMBL27570223 0.82 GLO1 (0.45) GLO1CYP2D6CYP2C19CYP2C9NPSR1
Ammonia Solution, Strong SCHEMBL2515160 0.81 GLO1 (0.41) GLO1CYP2D6CYP2C19CYP2C9NPSR1
SCHEMBL4391884 0.79 TDP1 (0.39) ALDH1A1HSD17B10MAPTTSHRHPGD
SCHEMBL23804468 0.79 TSHR (0.53) NPSR1ALDH1A1MAPTTSHR
Diethylamine SCHEMBL28357796 0.79 SOAT1 (0.40) GLO1CYP2D6CYP2C19CYP2C9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164789-A Composition comprising an encapsulate 宝洁公司 2021-07-23 CN claimed
WO-2020081639-A1 AQUEOUS BINDER COMPOSITION FOR AN ELECTRODE AND METHODS FOR PRODUCING THE SAME HERCULES LLC (US) 2020-04-23 WO claimed
US-5700374-A Pervaporation membranes and use thereof DEUTSCHE CARBONE AG (DE) 1997-12-23 US claimed
US-11940596-B2 Spectacle lens with antibacterial and/or antiviral properties and method for manufacturing the same CARL ZEISS VISION INTERNATIONAL GMBH (DE) 2024-03-26 US disclosed
US-11667609-B2 Compound, composition containing said compound, self-healing material, surface coating agent, paint, adhesive, material for battery and cured product ADEKA CORPORATION (JP) 2023-06-06 US disclosed
US-20230161081-A1 SPECTACLE LENS WITH ANTIBACTERIAL AND/OR ANTIVIRAL PROPERTIES AND METHOD FOR MANUFACTURING THE SAME CARL ZEISS VISION INTERNATIONAL GMBH (DE) 2023-05-25 US disclosed
US-11365272-B2 Multi-copolymer, methods for producing the same and using thereof in wastewater treatment JIANGNAN UNIVERSITY (CN) 2022-06-21 US disclosed
CN-113164789-A Composition comprising an encapsulate 宝洁公司 2021-07-23 CN disclosed
CN-112638352-A Compositions comprising benefit agent-containing delivery particles 恩盖普有限公司 2021-04-09 CN disclosed
US-20200277425-A1 MULTI-COPOLYMER, METHODS FOR PRODUCING THE SAME AND USING THEREOF IN WASTEWATER TREATMENT JIANGNAN UNIVERSITY (CN) 2020-09-03 US disclosed
WO-2020081639-A1 AQUEOUS BINDER COMPOSITION FOR AN ELECTRODE AND METHODS FOR PRODUCING THE SAME HERCULES LLC (US) 2020-04-23 WO disclosed
US-20160243490-A1 PROCESS FOR CAPTURING CO2 FROM A CO2-CONTAINING GAS STREAM INVOLVING PHASE SEPARATION OF AQUEOUS ABSORBENT CARBONORO B.V. (NL) 2016-08-25 US disclosed
US-7726802-B2 Ink set for inkjet recording, and image recording method and image recording apparatus FUJIFILM CORPORATION (JP) 2010-06-01 US disclosed
CN-101534802-A Disinfecting surfaces SEARETE LLC (US) 2009-09-16 CN disclosed
US-20070229577-A1 Ink set for inkjet recording, and image recording method and image recording apparatus FUJIFILM CORPORATION (JP) 2007-10-04 US disclosed
US-20070222832-A1 Ink tank assembly for inkjet system, and image forming apparatus FUJIFILM CORPORATION 2007-09-27 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 (1 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-11667609-B2 Compound, composition containing said compound, self-healing material, surface coating agent, paint, adhesive, material for battery and cured product H1-0, H1-10, RAD51 GLO1 2800/4885CYP2D6 3379/4885CYP2C19 1984/4885

“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.