SCHEMBL59949

SCHEMBL59949

CC(C)CCn1c(=O)[nH]c2nc[nH]c2c1=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 11/20 0.72
ADORA2A P29274 9/20 0.72
ADORA3 P0DMS8 7/20 0.72
PDE4A P27815 7/20 0.72
PDE4B Q07343 7/20 0.72
PDE4C Q08493 7/20 0.72
PDE4D Q08499 7/20 0.72
PDE2A O00408 3/20 0.56
PDE1A P54750 2/20 0.56
PDE1B Q01064 2/20 0.56
PDE1C Q14123 2/20 0.56
CFTR P13569 2/20 0.47
ADORA1 P30542 2/20 0.44
PDE3A Q14432 2/20 0.44
PDE5A O76074 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
SCN1A P35498 1/20 0.44

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
Phosphoric Acid SCHEMBL8500178 0.94 ADORA2B (0.64) ADORA2BADORA2AADORA3PDE4APDE4B
Xanthine SCHEMBL692608 0.91 ADORA2B (0.61) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL60158 0.85 ADORA2A (0.70) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL4423680 0.84 ADORA2B (1.00) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL27256851 0.83 ADORA2B (0.68) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL5451521 0.83 ADORA2B (0.68) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL27395394 0.81 ADORA2B (1.00) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL6233166 0.81 ADORA2B (1.00) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL4602969 0.81 ADORA2B (0.73) ADORA2BADORA2AADORA3PDE4APDE4B
SCHEMBL380135 0.80 ADORA2A (1.00) ADORA2BADORA2AADORA3PDE4APDE4B

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

Appears in 7674 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025233983-A1 DRUGS AND COMPOSITIONS FOR USE IN THE TREATMENT OF RETT SYNDROME UNIVERSITA' DEGLI STUDI DI TRIESTE (IT) 2025-11-13 WO claimed
US-20250325591-A1 THERAPY FOR HEPATIC DISORDERS USING ADIPOSE-DERIVED MESENCHYMAL STEM CELL LINE UNIV KEIO (JP) 2025-10-23 US claimed
US-20250283041-A1 METHODS FOR PRODUCING RED BLOOD CELLS ALBERT EINSTEIN COLLEGE MEDICINE (US) 2025-09-11 US claimed
US-20250115872-A1 GENERATION OF BROWN ADIPOCYTES FROM HUMAN PLURIPOTENT STEM CELLS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2025-04-10 US claimed
EP-4532693-A1 METHODS FOR PRODUCING RED BLOOD CELLS Albert Einstein College of Medicine (US) 2025-04-09 EP claimed
WO-2025033531-A1 TREATMENT OF TENDON DISORDERS USING PLATELETS PRODUCED FROM ADIPOSE TISSUE-DERIVED MESENCHYMAL STEM CELL LINE 慶應義塾 2025-02-13 WO claimed
US-20240415893-A1 TREATMENT FOR KNEE OSTEOARTHRITIS USING ADIPOSE TISSUE-DERIVED MESENCHYMAL STEM CELL LINE KEIO UNIVERSITY (JP) 2024-12-19 US claimed
EP-4473093-A1 GENERATION OF BROWN ADIPOCYTES FROM HUMAN PLURIPOTENT STEM CELLS The Brigham and Women's Hospital, Inc. (US) 2024-12-11 EP claimed
CN-118871570-A Production of brown adipocytes from human pluripotent stem cells 布里格姆妇女医院 2024-10-29 CN claimed
EP-4450075-A1 THERAPY FOR HEPATIC DISORDERS USING ADIPOSE-DERIVED MESENCHYMAL STEM CELL LINE Keio University (JP) 2024-10-23 EP claimed
EP-0564786-A2 Method for processing and preserving collagen-based tissues for transplantation LIFECELL CORPORATION (US) 1993-10-13 EP claimed
EP-0544862-A1 Methods and compositions for the prevention, diagnosis, and treatment of inflammatory serosal diseases and related conditions BAXTER INTERNATIONAL INC. (US) 1993-06-09 EP claimed
WO-1992021981-A1 METHODS AND COMPOSITIONS FOR THE PREVENTION, DIAGNOSIS, AND TREATMENT OF INFLAMMATORY SEROSAL DISEASE AND RELATED CONDITIONS BAXTER INTERNATIONAL INC. (US) 1992-12-10 WO claimed
EP-0308460-B1 A COMPOSITION FOR THE TOPICAL TREATMENT OF GLAUCOMA OR OCULAR HYPERTENSION Kabi Pharmacia AB (SE) 1992-07-29 EP claimed
US-5079253-A COMPOSITION FOR THE TOPICAL TREATMENT OF GLAUCOMA OR OCULAR HYPERTENSION PHARMACIA AB (SE) 1992-01-07 US claimed
US-4902690-A SYNERGISTIC COMBINATION OF PHOSPHODIESTERASE INHIBITOR AND OCTOPAMINE AGONIST THE GENERAL HOSPITAL CORPORATION (US) 1990-02-20 US claimed
EP-0308460-A1 A COMPOSITION FOR THE TOPICAL TREATMENT OF GLAUCOMA OR OCULAR HYPERTENSION. PHARMACIA AB (SE) 1989-03-29 EP claimed
US-4800081-A CALCIUM INFLUX BLOCKER SYNERGISTIC WITH INTERFERON OR CYCLIC NUCLEOTIDE MODULATOR BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1989-01-24 US claimed
WO-1988007380-A1 A COMPOSITION FOR THE TOPICAL TREATMENT OF GLAUCOMA OR OCULAR HYPERTENSION PHARMACIA AB (SE) 1988-10-06 WO claimed
WO-1987007508-A1 METHODS AND COMPOSITIONS FOR TREATING VIRAL INFECTIONS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1987-12-17 WO claimed