SCHEMBL1104878

SCHEMBL1104878

COc1cc(OC)c(Br)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.52
GRIN3B O60391 1/20 0.52
GRIN1 Q05586 1/20 0.52
GRIN2A Q12879 1/20 0.52
GRIN2B Q13224 1/20 0.52
GRIN2C Q14957 1/20 0.52
GRIN3A Q8TCU5 1/20 0.52
HTR2A P28223 8/20 0.50
HTR2C P28335 3/20 0.50
TAAR1 Q96RJ0 3/20 0.50
HTR2B P41595 1/20 0.50
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
AXL P30530 1/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALOX5 P09917 1/20 0.46
PTGS2 P35354 1/20 0.46
CA2 P00918 1/20 0.46

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
SCHEMBL30202128 0.91 POLB (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL580565 0.91 POLB (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28799442 0.91 POLB (0.61) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL298224 0.90 POLB (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3297985 0.84 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10122740 0.84 TSHR (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30081128 0.82 AXL (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29815010 0.82 GRIN2D (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17913390 0.82 AXL (0.53) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28862709 0.82 GRIN2D (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232326-B Metal organic framework material, preparation thereof and application thereof in electrode material 吉林中科研伸科技有限公司 2023-02-14 CN claimed
CN-115232326-A Metal organic framework material, preparation thereof and application thereof in electrode material 吉林中科研伸科技有限公司 2022-10-25 CN claimed
CN-116023673-B Preparation method of two-dimensional and three-dimensional clover-shaped metal organic supermolecule and metal organic cage 黔南民族师范学院 2024-05-17 CN disclosed
US-11895917-B2 Material for organic electroluminescence device and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2024-02-06 US disclosed
CN-113845486-B Anthracene-based macrocyclic molecule, and preparation method and application thereof 南方科技大学 2023-09-26 CN disclosed
CN-115304615-B Heterocyclic compound, organic electroluminescent device, and electronic device 陕西莱特光电材料股份有限公司 2023-07-14 CN disclosed
CN-116023673-A Preparation method of two-dimensional and three-dimensional clover-shaped metal organic supermolecule and metal organic cage 黔南民族师范学院 2023-04-28 CN disclosed
CN-115232326-B Metal organic framework material, preparation thereof and application thereof in electrode material 吉林中科研伸科技有限公司 2023-02-14 CN disclosed
US-20220407018-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2022-12-22 US disclosed
CN-115385955-A Tetrabiarylphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN disclosed
CN-115304615-A Heterocyclic compound, organic electroluminescent element, and electronic device 陕西莱特光电材料股份有限公司 2022-11-08 CN disclosed
WO-2009036161-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2009-03-19 WO disclosed
US-20080125594-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2008-05-29 US disclosed
US-20080125594-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2008-05-29 US disclosed
WO-2008033836-A2 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2008-03-20 WO disclosed
US-4487934-A Method of preparing poly-substituted acylbenzenes HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1984-12-11 US disclosed
EP-0041682-B1 A METHOD OF PREPARING POLY-SUBSTITUTED ACYLBENZENES HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1983-09-21 EP disclosed
EP-0045478-A1 A method of preparing poly-substituted acylbenzenes HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1982-02-10 EP disclosed
EP-0041682-A1 A method of preparing poly-substituted acylbenzenes HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1981-12-16 EP disclosed
US-4304941-A Method of preparing poly-substituted acylbenzenes HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) 1981-12-08 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 (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-20220407018-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME PPOX, EPCAM, STOM GRIN2D 149/4885GRIN3B 1794/4885GRIN1 444/4885
US-20080125594-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS TYMS, TYMP, POLB GRIN2D 3604/4885GRIN3B 3295/4885GRIN1 3983/4885
US-11895917-B2 Material for organic electroluminescence device and organic electroluminescence device using the same PPOX, EPCAM, STOM GRIN2D 149/4885GRIN3B 1794/4885GRIN1 444/4885

“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.