SCHEMBL59950

SCHEMBL59950

CC(C)Cc1nc2[nH]c(=O)n(C)c(=O)c2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 3/20 0.48
ADORA2A P29274 2/20 0.48
HTT P42858 1/20 0.40
CYP3A4 P08684 4/20 0.39
TSHR P16473 3/20 0.39
PDE1A P54750 2/20 0.39
PDE1B Q01064 2/20 0.39
PDE1C Q14123 2/20 0.39
BLM P54132 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP2C19 P33261 2/20 0.39
PDE5A O76074 1/20 0.39
CYP1A2 P05177 1/20 0.39
EGFR P00533 3/20 0.38
PDE2A O00408 1/20 0.38
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37

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 SCHEMBL8500180 0.93 ADORA2B (0.43) ADORA2BADORA2AHTTCYP3A4TSHR
Xanthine SCHEMBL692609 0.82 ADORA2B (0.54) ADORA2BADORA2ACYP3A4TSHRPDE1A
SCHEMBL6033611 0.82 ADORA2B (0.52) ADORA2BADORA2AHTT
SCHEMBL272518 0.81 TSHR (0.39) ADORA2BADORA2AHTTTSHR
SCHEMBL8519588 0.81 TSHR (0.36) ADORA2BADORA2AHTTCYP3A4TSHR
SCHEMBL2053840 0.80 TSHR (0.35) ADORA2BADORA2AHTTTSHRMEN1
SCHEMBL1892013 0.77 POLB (0.49) ADORA2BADORA2ACYP3A4MEN1KMT2A
SCHEMBL5461564 0.76 ADORA2B (0.51) ADORA2BADORA2ACYP3A4TSHRBLM
SCHEMBL295965 0.75 POLB (0.66) CYP3A4TSHRPDE1APDE1BPDE1C
SCHEMBL150603 0.75 GAA (0.45) CYP3A4TSHRPDE1APDE1BPDE1C

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 9997 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
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
WO-1992015282-A2 COMPOSITION AND METHOD FOR DELIVERY OF DRUGS INDIANA UNIVERSITY FOUNDATION (US) 1992-09-17 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
US-4337254-A ANTICOAGULANTS COMPRISING A PROSTACYCLIN AND A PHOSPHODIESTERASE INHIBITOR; PREVENTING LOWERING OF BLOOD PRESSURE BURROUGHS WELLCOME CO. (US) 1982-06-29 US claimed