SCHEMBL5076239

SCHEMBL5076239

Nc1cc(Br)c(N)c(Br)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 1.00
GAA P10253 1/20 1.00
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CA9 Q16790 4/20 0.50
CA3 P07451 1/20 0.50
GSK3B P49841 1/20 0.42
ALDH1A1 P00352 5/20 0.40
CYP3A4 P08684 3/20 0.40
TSHR P16473 1/20 0.37
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
TP53 P04637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
KMT2A Q03164 2/20 0.32
HTT P42858 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
CTSB P07858 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
SCHEMBL11537346 0.84 MAPT (0.72) MAPTGAACA1CA2CA9
SCHEMBL8132358 0.80 MAPT (0.65) MAPTGAACA1CA2CA9
SCHEMBL525650 0.80 CYP3A4 (0.65) MAPTGAACA1CA2CA9
SCHEMBL29210 0.79 GAA (0.65) MAPTGAACA1CA2CA9
SCHEMBL866225 0.79 MAPT (0.65) MAPTGAACA1CA2CA9
SCHEMBL9323230 0.79 MAPT (0.65) MAPTGAACA1CA2CA9
SCHEMBL3198004 0.79 MAPT (0.65) MAPTGAACA1CA2CA9
Methane SCHEMBL29198072 0.76 MAPT (0.61) MAPTGAACA1CA2CA9
SCHEMBL2438192 0.76 GAA (0.59) MAPTGAACA1CA2CA9
SCHEMBL14404326 0.74 GAA (0.56) MAPTGAACA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114805805-B Polyimide with high adhesive strength and preparation method and application thereof 深圳先进电子材料国际创新研究院 2023-12-19 CN claimed
CN-112640166-B Negative electrode, method for producing negative electrode, and binder for electrode 株式会社丰田自动织机 2023-10-27 CN claimed
CN-114805805-A Polyimide with high bonding strength and preparation method and application thereof 中国科学院深圳先进技术研究院 2022-07-29 CN claimed
CN-114573805-A Preparation method of high-barrier transparent flame-retardant copolymerized nylon 浙江恒逸石化研究院有限公司 2022-06-03 CN claimed
US-6262217-B1 USEFUL AS AN IMPREGNATING BONDING AGENT FOR TEXTILE SUBSTRATES, SUCH AS FABRICS AND MULTIFILAMENT CORDS LORD CORPORATION 2001-07-17 US claimed
US-4089822-A Novel polyurethane curative AMERICAN CYANAMID COMPANY (US) 1978-05-16 US claimed
CN-119350563-B Polymer capable of being assembled with protein and hydrophobic small molecule medicine and preparation method thereof 至微(深圳)医学科技有限公司 2025-04-04 CN disclosed
CN-119350563-A Polymer capable of being assembled with protein and hydrophobic small molecule medicine and preparation method thereof 至微(深圳)医学科技有限公司 2025-01-24 CN disclosed
US-12132201-B2 Negative electrode and method for producing negative electrode, and electrode binding agent KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2024-10-29 US disclosed
CN-114573805-B Preparation method of high-barrier transparent flame-retardant copolymerized nylon 浙江恒逸石化研究院有限公司 2024-03-08 CN disclosed
CN-114805805-B Polyimide with high adhesive strength and preparation method and application thereof 深圳先进电子材料国际创新研究院 2023-12-19 CN disclosed
CN-112640166-B Negative electrode, method for producing negative electrode, and binder for electrode 株式会社丰田自动织机 2023-10-27 CN disclosed
CN-113201804-B Fiber and preparation method thereof 上海邃铸科技有限公司 2023-05-09 CN disclosed
WO-1997032880-A1 PYRIMIDO[5,4-D]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION DR. KARL THOMAE GMBH (DE) 1997-09-12 WO disclosed
EP-0779888-A1 PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM Dr. Karl Thomae GmbH (DE) 1997-06-25 EP disclosed
WO-1996007657-A1 PYRIMIDO[5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM DR. KARL THOMAE GMBH (DE) 1996-03-14 WO disclosed
EP-0164523-A1 Tires and wheels from low heat buildup polyurethane compositions AIR PRODUCTS AND CHEMICALS, INC. (US) 1985-12-18 EP disclosed
US-4556703-A Low heat buildup polyurethane compositions and articles AMERICAN CYANAMID COMPANY (US) 1985-12-03 US disclosed
US-4089822-A Novel polyurethane curative AMERICAN CYANAMID COMPANY (US) 1978-05-16 US disclosed
US-3978038-A POLYAMIDES, POLYESTERS, POLYURETHANES CIBA-GEIGY CORPORATION (US) 1976-08-31 US disclosed