SCHEMBL3708440

SCHEMBL3708440

COc1cc(N)c(F)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
HTR2A P28223 4/20 0.47
TAAR1 Q96RJ0 3/20 0.47
HTR2C P28335 1/20 0.47
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.40
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
GRIN3A Q8TCU5 1/20 0.40

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
SCHEMBL29934779 0.92 POLB (0.57) POLBL3MBTL1HTR2ATAAR1HTR2C
SCHEMBL16650823 0.92 POLB (0.57) POLBL3MBTL1HTR2ATAAR1HTR2C
SCHEMBL3341643 0.83 POLB (0.52) POLBL3MBTL1HTR2ATAAR1HTR2C
SCHEMBL25095598 0.83 TDP1 (0.43) POLBL3MBTL1MAPTNPC1
SCHEMBL29447103 0.82 POLB (0.67) POLBL3MBTL1HTR2ATAAR1HTR2C
SCHEMBL1766204 0.82 NPC1 (0.46) POLBL3MBTL1HTR2AHTR2CMAPT
SCHEMBL1359709 0.82 HTR2A (0.48) POLBL3MBTL1HTR2ATAAR1HTR2C
SCHEMBL192738 0.82 POLB (0.67) POLBL3MBTL1HTR2ATAAR1HTR2C
SCHEMBL30536258 0.82 HTR2A (0.48) POLBL3MBTL1HTR2ATAAR1HTR2C
Hydrochloric Acid SCHEMBL1401340 0.80 POLB (0.64) POLBL3MBTL1HTR2ATAAR1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4744661-A2 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2026-05-20 EP disclosed
EP-4298092-B1 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2025-11-26 EP disclosed
EP-4626860-A1 FUSED PYRROLYL-SULFONAMIDE COMPOUNDS ReWind Therapeutics NV (BE) 2025-10-08 EP disclosed
WO-2025092989-A1 SUBSTITUTED QUINAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMBINATION THEREOF, AND USE THEREOF 泰州红云制药有限公司 2025-05-08 WO disclosed
CN-118619959-A Hydrazide compound, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2024-09-10 CN disclosed
WO-2024115733-A1 FUSED PYRROLYL-SULFONAMIDE COMPOUNDS REWIND THERAPEUTICS NV (BE) 2024-06-06 WO disclosed
US-20240025883-A1 PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-25 US disclosed
EP-4298092-A1 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-01-03 EP disclosed
CN-116829550-A Pyrimidine-2-ylsulfonamide derivatives 豪夫迈·罗氏有限公司 2023-09-29 CN disclosed
US-11649224-B2 IRE1 small molecule inhibitors CORNELL UNIVERSITY (US) 2023-05-16 US disclosed
WO-2012064269-A1 COMPOUNDS AND THEIR USE FOR TREATMENT OF Αβ-RELATED DISEASES ASTRAZENECA AB (SE) 2012-05-18 WO disclosed
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases ASTRAZENECA AB (SE) 2012-05-17 US disclosed
CN-1478092-A Benzoxazinone derivatives, their preparation and use ʷ 2004-02-25 CN disclosed
US-5191105-A Chemical intermediates SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1993-03-02 US disclosed
US-5030760-A Chemical intermediates; herbicides SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1991-07-09 US disclosed
US-4818276-A Herbicidal 1-aryl-Δ2 -1,2,4-triazolin-5-ones FMC CORPORATION (US) 1989-04-04 US disclosed
EP-0231176-A1 HERBICIDAL 1-ARYL-$g(d)?2 -1,2,4-TRIAZOLIN-5-ONES FMC Corporation (US) 1987-08-12 EP disclosed
WO-1987000730-A1 HERBICIDAL 1-ARYL-delta2-1,2,4-TRIAZOLIN-5-ONES FMC CORPORATION (US) 1987-02-12 WO disclosed
CN-85106905-A Contain 1-aryl-Δ 2-1,2,4, weedicide of-triazoline-5-ketone and preparation method thereof 1987-02-04 CN disclosed
US-4484940-A Tetrahydrophthalimides, and their production and use as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-11-27 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-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases APP, BACE1, PSEN1 POLB 2974/4885L3MBTL1 4304/4885HTR2A 2243/4885
US-20240025883-A1 PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES GPR17, GPR27, GPR119 POLB 3512/4885L3MBTL1 4583/4885HTR2A 760/4885
US-11649224-B2 IRE1 small molecule inhibitors XBP1, ERN2, ERN1 POLB 2859/4885L3MBTL1 446/4885HTR2A 4627/4885

“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.