SCHEMBL423294

SCHEMBL423294

Cc1cccc2c1OC(F)(F)O2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.35
ALOX15 P16050 1/20 0.34
MPO P05164 1/20 0.33
HTR2C P28335 2/20 0.33
GPR3 P46089 1/20 0.33
CD44 P16070 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
STIM1 Q13586 1/20 0.32
ORAI1 Q96D31 1/20 0.32
IDO1 P14902 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
HTR1A P08908 2/20 0.31
DRD2 P14416 2/20 0.31
HTR2A P28223 2/20 0.31
BACE1 P56817 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL7693244 0.83 HTR2C (0.33) HTR2CCD44CYP1A2CYP2A6CA1
SCHEMBL14547572 0.82 HTR2C (0.32) HTR2CCD44CYP1A2CYP2A6CA1
SCHEMBL30677836 0.81 FFAR4 (0.37) ADORA2AALOX15MPOHTR2CGPR3
SCHEMBL21937643 0.80 HTR2C (0.31) HTR2CCD44CYP1A2CYP2A6
SCHEMBL14747859 0.80 HTR2C (0.31) HTR2CCD44CYP1A2CYP2A6
SCHEMBL9058839 0.79 HTR2C (0.30) HTR2C
SCHEMBL6127936 0.77 ADORA2A (0.31) ADORA2A
SCHEMBL10522329 0.77 ALDH1A1 (0.46) HTR2CCD44CYP1A2CYP2A6HTR1A
SCHEMBL8952145 0.76 MPO (0.34) ADORA2AALOX15MPOGPR3IDO1
SCHEMBL6264335 0.75 AHR (0.45) MPOHTR2CGPR3CYP1A2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239801-A1 PYRIMIDO[5,4,D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF Université de Montréal (CA) 2024-07-18 US disclosed
US-20240239801-A1 PYRIMIDO[5,4,D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF Université de Montréal (CA) 2024-07-18 US disclosed
US-20240238304-A1 Small Molecule Degraders of DOT1L and Uses Thereof NORTHWESTERN UNIVERSITY 2024-07-18 US disclosed
US-20240217971-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE Université de Montréal (CA) 2024-07-04 US disclosed
US-20240217971-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE Université de Montréal (CA) 2024-07-04 US disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
EP-3483144-B1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD CONTROLLING AGENT CONTAINING SAME SUMITOMO CHEMICAL CO (JP) 2023-10-11 EP disclosed
US-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-10 US disclosed
US-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-10 US disclosed
US-20230303586-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-09-28 US disclosed
EP-0291799-B1 DIOXYALKYLENEARYL-DIHYDROPYRIDINES AND THEIR INTERMEDIARY COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE BAYER AG (DE) 1993-06-16 EP disclosed
US-4886816-A CARDIOTONIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1989-12-12 US disclosed
EP-0291799-A2 Dioxyalkylenearyl-dihydropyridines and their intermediary compounds, process for their preparation and their use BAYER AG (DE) 1988-11-23 EP disclosed
US-4596880-A Pesticides BAYER AKTIENGESELLSCHAFT (DE) 1986-06-24 US disclosed
EP-0006978-B1 BENZYL ESTERS WITH FLUORINATED ETHER AND/OR THIOETHER GROUPS, THEIR PREPARATIONS AND THEIR USE AS INSECTICIDES; INTERMEDIATE PRODUCTS AND THEIR PREPARATIONS BAYER AG (DE) 1986-01-29 EP disclosed
EP-0041131-B1 PREPARATION OF FLUORO-SUBSTITUTED BENZODIOXOLES AND BENZODIOXANES BAYER AG (DE) 1984-06-13 EP disclosed
US-4438275-A 2,2-DIFLUORO-BENZODIOXOLES BAYER AKTIENGESELLSCHAFT (DE) 1984-03-20 US disclosed
US-4310540-A PYRETHROID-LIKE COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1982-01-12 US disclosed
EP-0041131-A2 Preparation of fluoro-substituted benzodioxoles and benzodioxanes BAYER AG (DE) 1981-12-09 EP disclosed
EP-0006978-A2 Benzyl esters with fluorinated ether and/or thioether groups, their preparations and their use as insecticides; intermediate products and their preparations BAYER AG (DE) 1980-01-23 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 (6 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-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS ADORA2A 188/4885ALOX15 3381/4885MPO 1162/4885
US-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same C5, PRXL2A, NOX3 ADORA2A 1005/4885ALOX15 2263/4885MPO 2984/4885
US-20240239801-A1 PYRIMIDO[5,4,D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF NRAS, BRAF, KRAS ADORA2A 2478/4885ALOX15 3400/4885MPO 3450/4885
US-20240238304-A1 Small Molecule Degraders of DOT1L and Uses Thereof DOT1L, STUB1, BAZ2B ADORA2A 4544/4885ALOX15 4100/4885MPO 3381/4885
US-20230303586-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS ADORA2A 2137/4885ALOX15 4573/4885MPO 3489/4885
US-20240217971-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE BRAF, NRAS, DPYD ADORA2A 2078/4885ALOX15 3249/4885MPO 4279/4885

“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.