SCHEMBL57305

SCHEMBL57305

Nc1ncnn2c(Br)ccc12

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.44
CHRNA7 P36544 1/20 0.34
HTR3A P46098 1/20 0.34
KCNH2 Q12809 1/20 0.34
TNIK Q9UKE5 1/20 0.33
RIPK1 Q13546 2/20 0.31
PIK3CD O00329 1/20 0.31
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
ADORA1 P30542 1/20 0.30

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
SCHEMBL20820178 0.79 MAP4K4 (0.47) MAP4K4TNIKRIPK1
SCHEMBL15740086 0.78 MAP4K4 (0.46) MAP4K4TNIKRIPK1PIK3CD
SCHEMBL13075167 0.76 MAP4K4 (0.44) MAP4K4TNIKRIPK1
SCHEMBL868211 0.76 CHRNA7 (0.34) CHRNA7HTR3AKCNH2
SCHEMBL17238976 0.76 MAP4K4 (0.44) MAP4K4CHRNA7HTR3ATNIKRIPK1
SCHEMBL6844956 0.76 CHRNA7 (0.34) CHRNA7HTR3AKCNH2
SCHEMBL64667 0.76 MAP4K4 (0.44) MAP4K4CHRNA7HTR3ATNIKRIPK1
SCHEMBL22326695 0.74 MAP4K4 (0.43) MAP4K4TNIKRIPK1
SCHEMBL24236922 0.73 MAP4K4 (0.42) MAP4K4TNIKRIPK1PIK3CD
SCHEMBL21137294 0.73 MAP4K4 (0.42) MAP4K4TNIKRIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116332996-B L-ribofuranose type anti-coronavirus compound, and preparation method and application thereof 南京颐媛生物医学研究院有限公司 2025-04-01 CN claimed
CN-117126199-B Fluororad West-Wei synthesis method 江西师范大学 2024-12-06 CN claimed
CN-117126199-A Synthesis method of fluoroRuidexivir 江西师范大学 2023-11-28 CN claimed
CN-116478171-A Simple preparation method of 4-amino-7-halogenopyrrolo [2, l-f ] [ l,2,4] triazine 威海同丰海洋生物科技有限公司 2023-07-25 CN claimed
CN-116332996-A Anti-coronavirus compound, preparation method and application thereof 南京颐媛生物医学研究院有限公司 2023-06-27 CN claimed
CN-111205327-B Preparation method of Reideciclovir 南京法恩化学有限公司 2022-05-31 CN claimed
CN-111205327-A Preparation method of Reidesciclovir 南京法恩化学有限公司 2020-05-29 CN claimed
CN-110776512-A Preparation method of nucleoside analogue 成都傲飞生物化学品有限责任公司 2020-02-11 CN claimed
EP-4105216-B1 DIHYDRONAPHTHYRIDINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF GENFLEET THERAPEUTICS SHANGHAI INC (CN) 2026-05-20 EP disclosed
CN-122055366-A GCN2 and PERK kinase modulators and methods of use thereof 德西费拉制药有限责任公司 2026-05-15 CN disclosed
EP-4719606-A2 GCN2 AND PERK KINASE MODULATORS AND METHODS OF USE THEREOF Deciphera Pharmaceuticals, LLC (US) 2026-04-08 EP disclosed
US-12583879-B2 Method for synthesizing C-nucleoside compound SICHUAN UNIVERSITY (CN) 2026-03-24 US disclosed
EP-4705313-A2 4'-SUBSTITUTED NUCLEOSIDES AND NUCLEOTIDES AS ANTIVIRAL AGENTS The Scripps Research Institute (US) 2026-03-11 EP disclosed
US-12558364-B2 Next generation remdesivir antivirals REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2026-02-24 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 US disclosed
EP-1957485-A2 SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS Bayer Healthcare, LLC (US) 2008-08-20 EP disclosed
EP-1945222-A2 PYRROLO[2,1-F] [1,2,4] TRIAZIN-4-YLAMINES IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES Bayer HealthCare AG (DE) 2008-07-23 EP disclosed
WO-2007064931-A2 SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS BAYER HEALTHCARE LLC (US) 2007-06-07 WO disclosed
WO-2007064931-A2 SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS BAYER HEALTHCARE LLC (US) 2007-06-07 WO disclosed
WO-2007056170-A2 PYRROLO[2,1-F] [1,2,4] TRIAZIN-4-YLAMINES IGF-1R KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER HYPERPROLIFERATIVE DISEASES BAYER HEALTHCARE AG (DE) 2007-05-18 WO 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-12558364-B2 Next generation remdesivir antivirals SARS1, ACE2, ACE MAP4K4 1377/4885CHRNA7 2519/4885HTR3A 824/4885
US-12583879-B2 Method for synthesizing C-nucleoside compound MTAP, NSUN2, BCDIN3D MAP4K4 3669/4885CHRNA7 2052/4885HTR3A 1732/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 MAP4K4 1512/4885CHRNA7 2372/4885HTR3A 314/4885

“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.