SCHEMBL443362

SCHEMBL443362

COc1cc(OC)c2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.57
CYP1A2 P05177 3/20 0.54
CYP2A6 P11509 1/20 0.54
MAPT P10636 2/20 0.53
CYP2D6 P10635 2/20 0.49
CDC25B P30305 2/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
LMNA P02545 2/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
CASP3 P42574 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
NQO2 P16083 2/20 0.46
CYP1A1 P04798 2/20 0.46
CYP1B1 Q16678 2/20 0.46
MAOA P21397 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45

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
SCHEMBL29370537 1.00 NQO1 (0.57) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL21117323 0.90 CYP1A2 (0.52) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL7857849 0.90 NQO1 (0.55) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL29861922 0.86 NQO1 (0.61) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL2764307 0.86 NQO1 (0.61) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL27996593 0.84 NQO1 (0.59) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL30064911 0.83 CYP1A2 (0.46) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL23043825 0.82 CYP1A2 (0.44) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL30706678 0.82 CYP1A2 (0.44) NQO1CYP1A2CYP2A6MAPTCYP2D6
SCHEMBL20315127 0.82 CDC25B (0.46) NQO1CYP1A2CYP2A6MAPTCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022023027-A1 NOVEL CHROMIUM-BASED CATALYTIC COMPOSITION AND ASSOCIATED METHOD FOR THE TRIMERISATION OF ETHYLENE TO HEXENE-1 IFP Energies Nouvelles (FR) 2022-02-03 WO claimed
EP-4188596-B1 ETHYLENE OLIGOMERISATION PROCESS COMPRISING IN SITU PREPARATION OF THE CATALYTIC COMPOSITION IFP ENERGIES NOW (FR) 2024-09-18 EP disclosed
CN-116217351-B Preparation method and application of 4-methoxy-2-naphthol 阜阳欣奕华制药科技有限公司 2024-06-14 CN disclosed
CN-118043368-A Aralkyl resin, diluent for epoxy resin, curable resin composition, photosensitive resin composition, cured product, electronic device, and process for producing aralkyl resin 中央硝子株式会社 2024-05-14 CN disclosed
CN-115403451-B Preparation method and application of 4-methoxy-2-naphthol 阜阳欣奕华制药科技有限公司 2024-01-19 CN disclosed
CN-115504870-B Preparation method and application of 4-methoxy-2-naphthol 阜阳欣奕华制药科技有限公司 2023-09-26 CN disclosed
CN-115504866-B Preparation method and application of 4-methoxy-2-naphthol 阜阳欣奕华制药科技有限公司 2023-09-26 CN disclosed
CN-115433062-B Preparation method and application of 4-methoxy-2-naphthol 阜阳欣奕华制药科技有限公司 2023-09-19 CN disclosed
US-20230279025-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2023-09-07 US disclosed
US-20230271898-A1 ETHYLENE OLIGOMERISATION PROCESS COMPRISING IN SITU PREPARATION OF THE CATALYTIC COMPOSITION IFP Energies Nouvelles (FR) 2023-08-31 US disclosed
EP-0356247-A1 Analgesic carboxylic acid amide derivatives Sankyo Company Limited (JP) 1990-02-28 EP disclosed
US-4804679-A INHIBIT CHOLESTEROL BIOSYNTHESIS SANDOZ PHARM. CORP. (US) 1989-02-14 US disclosed
US-4686237-A LOWERING BLOOD CHOLESTEROL LEVEL SANDOZ PHARMACEUTICALS CORP. (US) 1987-08-11 US disclosed
EP-0117228-B1 ANALOGS OF MEVALONOLACTONE AND DERIVATIVES THEREOF, PROCESSES FOR THEIR PRODUCTION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS PHARMACEUTICALS SANDOZ AG (CH) 1986-11-05 EP disclosed
EP-0117228-A1 Analogs of mevalonolactone and derivatives thereof, processes for their production, pharmaceutical compositions containing them and their use as pharmaceuticals SANDOZ AG (CH) 1984-08-29 EP disclosed
WO-1984002903-A1 MEVALONOLACTONE ANALOGS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS SANDOZ AG (CH) 1984-08-02 WO disclosed
US-4229274-A PHOTOINITIATOR, PHOTOSENSITIZER, QUENCHER, AND COMPOUNDS CONTAINING ACRYLYLOXY GROUPS PPG INDUSTRIES, INC. (US) 1980-10-21 US disclosed
US-4154715-A Polymeric polyblend compositions toughened by addition of liquid polymers of a conjugated diene monomer MONSANTO COMPANY (US) 1979-05-15 US disclosed
US-4049732-A Continuous telomerization process and its liquid products LITHIUM CORPORATION OF AMERICA (US) 1977-09-20 US disclosed
US-4041088-A Recirculation telomerization process and its liquid telomers and liquid telomers produced thereby LITHIUM CORPORATION OF AMERICA (US) 1977-08-09 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-20230279025-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS NQO1 480/4885CYP1A2 4527/4885CYP2A6 3249/4885
US-20230271898-A1 ETHYLENE OLIGOMERISATION PROCESS COMPRISING IN SITU PREPARATION OF THE CATALYTIC COMPOSITION GALE, EXOC4, EXOC1 NQO1 2439/4885CYP1A2 582/4885CYP2A6 875/4885

“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.