SCHEMBL2750595

SCHEMBL2750595

Cc1cccc(C)c1-c1cc[c]cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
GRIA1 P42261 3/20 0.37
CACNG8 Q8WXS5 3/20 0.37
CD44 P16070 1/20 0.37
TSHR P16473 2/20 0.36
ACHE P22303 1/20 0.36
HTR7 P34969 1/20 0.36
CYP3A4 P08684 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
PIK3CA P42336 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SRC P12931 2/20 0.35
FABP4 P15090 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 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
SCHEMBL28251645 0.93 ALDH1A1 (0.37) CYP1A2CYP2A6GRIA1CACNG8CD44
SCHEMBL27910922 0.84 GRIA1 (0.42) GRIA1CACNG8TSHRALDH1A1SRC
SCHEMBL27943320 0.82 CD44 (0.42) CD44TSHRCYP3A4CA1CA2
SCHEMBL29037313 0.82 TAAR1 (0.38) TSHRHTR7
SCHEMBL2280826 0.82 GABRA1 (0.46) TSHRCA2ALDH1A1TDP1
SCHEMBL25308417 0.78 TDP2 (0.38)
SCHEMBL1070019 0.78 RAPGEF4 (0.33) CYP1A2CYP2A6ALDH1A1TDP1
SCHEMBL3534700 0.78 TSHR (0.53) TSHRACHECYP3A4CA1CA2
SCHEMBL28467302 0.76 CYP2A6 (0.31) CYP2A6
SCHEMBL9957903 0.76 MEN1 (0.37) CYP1A2HTR7ALDH1A1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315883-B Dibenzofuran phenol IVB metal complex and preparation method thereof, catalyst system and olefin polymerization method 万华化学集团股份有限公司 2023-10-20 CN claimed
CN-115385956-A Biaryl diphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
CN-114315883-A Dibenzofuran phenol IVB group metal complex, preparation method thereof, catalyst system and olefin polymerization method 万华化学集团股份有限公司 2022-04-12 CN claimed
CN-112358498-A Tetraaryloxy IVB group binuclear metal complex and preparation and application thereof 万华化学集团股份有限公司 2021-02-12 CN claimed
CN-112142775-A Phenolphenanthroline IVB group metal complex and preparation and application thereof 万华化学集团股份有限公司 2020-12-29 CN claimed
CN-111018923-A Carbohydrate monophosphines, process for their preparation and their use 东莞市均成高新材料有限公司 2020-04-17 CN claimed
CN-111018923-B Carbohydrate monophosphines, method for the production and use thereof 东莞市均成高新材料有限公司 2024-04-19 CN disclosed
US-20240122065-A1 METAL PATTERNING MATERIAL, AMINE COMPOUND, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN TOSOH CORPORATION (JP) 2024-04-11 US disclosed
EP-4342883-A1 PHOTOELECTRIC CONVERSION ELEMENT MATERIAL FOR IMAGING ELEMENT AND PHOTOELECTRIC CONVERSION ELEMENT FOR IMAGING ELEMENT Tosoh Corporation (JP) 2024-03-27 EP disclosed
CN-117044428-A Lateral current suppressing material, carbazole compound, hole injection layer, and organic electroluminescent element 东曹株式会社 2023-11-10 CN disclosed
CN-114315883-B Dibenzofuran phenol IVB metal complex and preparation method thereof, catalyst system and olefin polymerization method 万华化学集团股份有限公司 2023-10-20 CN disclosed
EP-3621946-B1 INDANE DERIVATIVES AND THEIR USE IN ORGANIC ELECTRONICS DOTTIKON ES HOLDING AG (CH) 2023-09-06 EP disclosed
CN-110740986-B Indane derivatives and their use in organic electronic devices 多蒂肯独家合成控股公司 2023-08-25 CN disclosed
US-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds BASF SE (DE) 2010-03-18 US disclosed
CN-1561317-A Chain extension reaction method BP CHEM INT LTD (GB) 2005-01-05 CN disclosed
EP-1054871-A2 PYRIMIDINES AND TRIAZINES AS INTEGRIN ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2000-11-29 EP disclosed
US-6060569-A USING AS COORDINATION CATALYSTS NOVEL NICKEL COMPLEXES IN WHICH THE NICKEL IS COORDINATED TO SELECTED PHOSPHOROUS SUBSTITUTED ARYL SULFONAMIDE LIGANDS; LUBRICANTS OR IN WAXES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-09 US disclosed
WO-1999050249-A2 PYRIMIDINES AND TRIAZINES AS INTEGRIN ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-10-07 WO disclosed
EP-0828737-A1 ISOXAZOLINE AND ISOXAZOLE DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-03-18 EP disclosed
US-5710159-A IMIDAZOLIN-2-YLAMINOPROPOXY)ISOXAZOL-5-CARBONYLAMINO-2 -BENZYLOXYCARBONYLAMINOPROPIONIC ACID AS ANTIINFLAMMATORY AGENTS, BONE DEGRADATION, TUMORS, METASTASES AND THROMBOSIS THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1998-01-20 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-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds TPMT, NISCH, PPA1 CYP1A2 1087/4885CYP2A6 1415/4885GRIA1 3419/4885

“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.