Sugi Predict

Sugi Predict / Compounds / SCHEMBL2255694

SCHEMBL2255694

SCHEMBL2255694

[c]1c2ccccc2cc2cc(-c3ccccc3)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 4/20 0.42
▸ ESR1 P03372 3/20 0.42
▸ NPC1 O15118 1/20 0.40
▸ BACE1 P56817 1/20 0.38
▸ DYRK3 O43781 1/20 0.38
▸ CLK1 P49759 1/20 0.38
▸ CLK2 P49760 1/20 0.38
▸ CLK3 P49761 1/20 0.38
▸ GSK3B P49841 1/20 0.38
▸ CDK5 Q00535 1/20 0.38
▸ DYRK1A Q13627 1/20 0.38
▸ CDK5R1 Q15078 1/20 0.38
▸ DYRK2 Q92630 1/20 0.38
▸ CLK4 Q9HAZ1 1/20 0.38
▸ DYRK1B Q9Y463 1/20 0.38
▸ ALOX5 P09917 2/20 0.38
▸ HSD17B1 P14061 1/20 0.37
▸ HSD17B2 P37059 1/20 0.37
▸ PGR P06401 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36

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
SCHEMBL14057855 0.94 ESR1 (0.39) ESR2ESR1NPC1ALOX5HSD17B1
Tannin Pyrogallol SCHEMBL28194208 0.92 ALDH1A1 (0.43) ESR2ESR1NPC1ALOX5ALDH1A1
SCHEMBL2257131 0.88 ESR1 (0.42) ESR2ESR1NPC1BACE1ALOX5
SCHEMBL24252 0.80 CYP2A6 (0.41) ALDH1A1KDM4EMEN1MAPTHPGD
SCHEMBL2022581 0.79 MAOA (0.44) ESR2ESR1NPC1BACE1ALOX5
SCHEMBL29093556 0.78 ESR1 (0.46) ESR2ESR1NPC1BACE1DYRK3
SCHEMBL28076506 0.78 ALDH1A1 (0.39) ALDH1A1KDM4EMEN1MAPTHPGD
Tannin Pyrogallol SCHEMBL28219339 0.77 ESR1 (0.33) ESR2ESR1NPC1ALDH1A1KDM4E
SCHEMBL195377 0.76 ALDH1A1 (0.36) ALDH1A1KDM4EMEN1MAPTHPGD
SCHEMBL2253487 0.76 ESR2 (0.42) ESR2ESR1NPC1BACE1DYRK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110168764-B Method of forming organic elements of electronic devices 默克专利有限公司 2023-04-04 — — CN disclosed
CN-110168765-B Method of forming organic Electroluminescent (EL) element 默克专利有限公司 2023-04-04 — — CN disclosed
CN-115867426-A Method for producing a mixture 默克专利有限公司 2023-03-28 — — CN disclosed
CN-106687563-B Preparation and electronic device 默克专利有限公司 2023-03-14 — — CN disclosed
CN-115700058-A Emulsions comprising organic functional materials 默克专利有限公司 2023-02-03 — — CN disclosed
CN-115427521-A Preparation of organic functional material 默克专利有限公司 2022-12-02 — — CN disclosed
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 — — CN disclosed
CN-112930606-A Method for forming organic element of electronic device 默克专利有限公司 2021-06-08 — — CN disclosed
CN-112912372-A Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-06-04 — — CN disclosed
CN-110446611-B Printing method for Organic Light Emitting Diodes (OLEDs) 默克专利有限公司 2021-05-25 — — CN disclosed
CN-101282959-B Thiophene compound having sulfonyl group and method for producing same NISSAN CHEMICAL IND LTD 2013-04-17 — — CN disclosed
EP-1882694-B1 OLIGOMERS AND POLYMERS OF THIOPHENE COMPOUNDS HAVING PHOSPHORIC ESTER AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL IND LTD (JP) 2013-04-03 — — EP disclosed
US-20120214993-A1 CYCLIC AZINE DERIVATIVES, PROCESSES FOR PRODUCING THESE, AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THESE AS COMPONENT SAGAMI CHEMICAL RESEARCH INSTITUTE, (JP) 2012-08-23 — — US disclosed
EP-2468731-A1 CYCLIC AZINE DERIVATIVES, PROCESSES FOR PRODUCING THESE, AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THESE AS COMPONENT Tosoh Corporation (JP) 2012-06-27 — — EP disclosed
US-8008425-B2 Thiophene compound having sulfonyl group and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-08-30 — — US disclosed
CN-102027631-A Dye for dye-sensitized solar cell and dye-sensitized solar cell NISSAN CHEMICAL IND LTD 2011-04-20 — — CN disclosed
US-20090127491-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-21 — — US disclosed
CN-101282959-A Thiophene compound having sulfonyl group and method for producing same NISSAN CHEMICAL IND LTD (JP) 2008-10-08 — — CN disclosed
CN-101208349-A Thiophene compound having phosphate ester and method for producing same NISSAN CHEMICAL IND LTD (JP) 2008-06-25 — — CN disclosed
EP-1916244-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2008-04-30 — — EP 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-20120214993-A1 CYCLIC AZINE DERIVATIVES, PROCESSES FOR PRODUCING THESE, AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THESE AS COMPONENT CPNE4, EPB41, AZI2 ESR2 251/4885ESR1 68/4885NPC1 3259/4885
US-20090127491-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME TST, ABCG2, CBR3 ESR2 2839/4885ESR1 3221/4885NPC1 1344/4885

“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.