SCHEMBL29354597

SCHEMBL29354597

CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)NCCN)cc4)nc32)[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 9/20 0.83
ADORA3 P0DMS8 7/20 0.83
ADORA1 P30542 7/20 0.83
ADORA2B P29275 4/20 0.83
KDM4E B2RXH2 3/20 0.83
ALOX15 P16050 2/20 0.83
HSD17B10 Q99714 2/20 0.83
KMT2A Q03164 2/20 0.83
TSHR P16473 1/20 0.83
MEN1 O00255 1/20 0.83
ALDH1A1 P00352 1/20 0.83
CYP2D6 P10635 1/20 0.83
CYP2C19 P33261 1/20 0.83
PMP22 Q01453 1/20 0.82
ATM Q13315 1/20 0.82

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
SCHEMBL8095238 1.00 ADORA2A (0.83) ADORA2AADORA3ADORA1ADORA2BKDM4E
SCHEMBL1104747 0.93 ADORA2A (0.82) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL12648395 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL724684 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
SCHEMBL10089214 0.91 ADORA2A (0.88) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL24178317 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL19807521 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL2318561 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
SCHEMBL20615307 0.91 ADORA2A (0.88) ADORA2AADORA3ADORA1ADORA2BKDM4E
SCHEMBL8923545 0.91 ADORA2A (0.88) ADORA2AADORA3ADORA1ADORA2BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743112-A1 ESCHERICHIA COLI NHAA MEMBRANE PROTEIN DRUG TARGET AND IMMUNOGENIC COMPOSITIONS THEREFROM Iowa State University Research Foundation, Inc. (US) 2026-05-20 EP claimed
EP-4686480-A1 LIVE ATTENUATED E. COLI VACCINE Institut für Virologie und Immunologie (IVI) (CH) 2026-02-04 EP claimed
WO-2025214786-A1 VIBRONIC MODULE OF A MODULAR MEASURING SYSTEM, AND MODULAR MEASURING SYSTEM ENDRESS+HAUSER FLOWTEC AG (CH) 2025-10-16 WO claimed
EP-4623922-A2 ALTERING MICROBIAL POPULATIONS & MODIFYING MICROBIOTA SNIPR Technologies Limited (GB) 2025-10-01 EP claimed
US-20250295747-A1 RECOMBINANT ATTENUATED SALMONELLA VACCINES (RASVS) AGAINST INFECTIONS BY AVIAN PATHOGENIC ESCHERICHIA COLI (APEC) HUVEPHARMA INC. (US) 2025-09-25 US claimed
EP-4608423-A1 BIOCONTROL COMPOSITIONS OF BACTERIOPHAGE, METHODS OF PRODUCING AND USES THEREOF Sug Biosciences LLC (US) 2025-09-03 EP claimed
US-12391866-B2 Surfactant mixtures for enhanced oil recovery SAUDI ARABIAN OIL COMPANY (SA) 2025-08-19 US claimed
CN-120148696-A Screening method of foam extinguishing agent components for photovoltaic power station based on molecular simulation 中国矿业大学(北京) 2025-06-13 CN claimed
CN-120005758-A Bacillus bailii FBV-24 and application thereof in inhibiting pathogenic escherichia coli of poultry 福建农林大学 2025-05-16 CN claimed
CN-119955498-A Viscous foam system for heavy oil in fracture-cavity reservoir and method for improving recovery ratio 中国石油大学(华东) 2025-05-09 CN claimed
CN-108474249-B Imaging subsurface formations and features using azimuthal phase encoding 斯伦贝谢技术有限公司 2022-07-26 CN claimed
CN-110151761-B Application of medicine substituting antibiotic-melatonin in resisting meningitis colibacillus pathogenic infection of children patient 扬州大学 2022-06-24 CN claimed
CN-113817297-B High-impact high-flame-retardant weather-resistant PBT/PC alloy material 湖南恒屹新材料有限公司 2022-06-14 CN claimed
EP-3999665-A1 METHOD FOR DETERMINING THE RISK OF AN AVIAN PATHOGENIC E. COLI (APEC) INFECTION IN AN AVIAN FLOCK Evonik Operations GmbH (DE) 2022-05-25 EP claimed
WO-2022067052-A1 PROBIOTIC BACILLUS COMPOSITIONS AND METHODS OF USE ELANCO US INC. (US) 2022-03-31 WO claimed
CN-113327271-B Decision-level target tracking method and system based on double-optical twin network and storage medium 北京理工大学重庆创新中心 2022-03-22 CN claimed
CN-114174539-A Method for determining the risk of Avian Pathogenic Escherichia Coli (APEC) infection in a flock of birds 赢创运营有限公司 2022-03-11 CN claimed
WO-2022026687-A1 SELF-DESTRUCTING SALMONELLA AS INNATE IMMUNITY ACTIVATOR TO IMPROVE FOOD SAFETY UNIVERSITY OF FLORIDA RESEARCH FOUNDATION INCORPORATED (US) 2022-02-03 WO claimed
CN-113999920-A Triple PCR identification kit and identification method for avian pathogenic escherichia coli 南京悦联生物科技有限公司 2022-02-01 CN claimed
CN-113989331-A Long-term target tracking method based on context multi-clue information and adaptive response 山西大学 2022-01-28 CN claimed