SCHEMBL1223972

SCHEMBL1223972

CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)nc2n(CCC)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 1.00
ADORA2A P29274 18/20 1.00
ADORA1 P30542 14/20 1.00
ADORA3 P0DMS8 13/20 1.00
CYP2D6 P10635 1/20 1.00
CYP2C9 P11712 1/20 1.00
CYP2C19 P33261 1/20 1.00
KDM4E B2RXH2 1/20 0.80
LMNA P02545 1/20 0.80
CYP1A2 P05177 1/20 0.80
CYP3A4 P08684 1/20 0.80
THRB P10828 1/20 0.80
BLM P54132 1/20 0.80
PMP22 Q01453 1/20 0.80
NPSR1 Q6W5P4 1/20 0.80

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
SCHEMBL7228294 0.93 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7221366 0.92 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7219818 0.92 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7223165 0.92 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7220488 0.91 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7223187 0.90 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7222372 0.90 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7228603 0.90 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7228609 0.90 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6
SCHEMBL7220779 0.90 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024189434-A1 USE OF NADOLOL TO TREAT PULMONARY SYMPTOMS ASSOCIATED WITH INFECTIONS WITH SARS-CoV-2 CHRONIC AIRWAY THERAPEUTICS LIMITED (AU) 2024-09-19 WO claimed
WO-2024168320-A1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING DEMENTIA ANAND RENE (US) 2024-08-15 WO claimed
US-20240219394-A1 METHOD FOR MEASURING RESPONSE OF OLFACTORY RECEPTOR TO SUBSTANCE AJINOMOTO CO., INC. (JP) 2024-07-04 US claimed
EP-4382612-A1 METHOD FOR MEASURING RESPONSE OF OLFACTORY RECEPTOR TO SUBSTANCE AJINOMOTO CO., INC. (JP) 2024-06-12 EP claimed
EP-4178948-A2 FUNCTIONALIZED ISONITRILES AND PRODUCTS, PREPARATION AND USES THEREOF Universidade de Santiago de Compostela (ES) 2023-05-17 EP claimed
WO-2023013791-A1 METHOD FOR MEASURING RESPONSE OF OLFACTORY RECEPTOR TO SUBSTANCE 味の素株式会社 2023-02-09 WO claimed
US-20220257603-A1 COMBINATION THERAPY FOR TREATING MTAP-DEFICIENT TUMORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-08-18 US claimed
US-20150297623-A1 METHODS FOR TREATMENT OF PRIMARY CANCER AND CANCER METASTASIS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2015-10-22 US claimed
US-20140271606-A1 METHODS OF USING ADENOSINE RECEPTOR ANTAGONISTS FOR TREATING BLEEDING DISORDERS BAYER HEALTHCARE LLC 2014-09-18 US claimed
WO-2014074529-A1 METHODS FOR TREATMENT OF PRIMARY CANCER AND CANCER METASTASIS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-05-15 WO claimed
WO-2004070000-A2 HTLV-I-CELL BINDING AND INHIBITION THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2004-08-19 WO claimed
US-12569445-B2 Particles comprising a therapeutic or diagnostic agent and suspensions and methods of use thereof HALOZYME HYPERCON, INC. (US) 2026-03-10 US disclosed
US-12558323-B2 Particle formation and morphology ELEKTROFI, INC. (US) 2026-02-24 US disclosed
US-20260007615-A1 PARTICLES COMPRISING A THERAPEUTIC OR DIAGNOSTIC AGENT AND SUSPENSIONS AND METHODS OF USE THEREOF ELEKTROFI INC (US) 2026-01-08 US disclosed
US-20260000616-A1 METHODS OF FORMING PARTICLES BY CONTINUOUS DROPLET FORMATION AND DEHYDRATION ELEKTROFI INC (US) 2026-01-01 US disclosed
US-20090208550-A1 Methods and compositions for treating hepatic diseases NEW YORK UNIVERSITY 2009-08-20 US disclosed
WO-2009055021-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATIC DISEASES NEW YORK UNIVERSITY SCHOOL OF MEDICINE (US) 2009-04-30 WO disclosed
WO-2008131922-A1 NEW 4,8-DIPHENYL-POLYAZANAPHTHALENE DERIVATIVES ALMIRALL, S.A. (ES) 2008-11-06 WO disclosed
WO-2004070000-A2 HTLV-I-CELL BINDING AND INHIBITION THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2004-08-19 WO disclosed
US-6545002-B1 Treating asthma, diarrhea, insulin resistance, diabetes, ischemia/reprefusion injuries, diabetic retinopathy or hyperbaric oxygen-induced retinopathy UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2003-04-08 US 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 (5 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-20260000616-A1 METHODS OF FORMING PARTICLES BY CONTINUOUS DROPLET FORMATION AND DEHYDRATION ALB, TNF, TTR ADORA2B 4301/4885ADORA2A 3439/4885ADORA1 4507/4885
US-12569445-B2 Particles comprising a therapeutic or diagnostic agent and suspensions and methods of use thereof ALB, S100P, S100A8 ADORA2B 3145/4885ADORA2A 2833/4885ADORA1 2871/4885
US-12558323-B2 Particle formation and morphology CD63, EXOSC10, EPCAM ADORA2B 4009/4885ADORA2A 3001/4885ADORA1 3176/4885
US-20260007615-A1 PARTICLES COMPRISING A THERAPEUTIC OR DIAGNOSTIC AGENT AND SUSPENSIONS AND METHODS OF USE THEREOF FLNB, FLNA, FUS ADORA2B 1022/4885ADORA2A 3104/4885ADORA1 2292/4885
US-20150297623-A1 METHODS FOR TREATMENT OF PRIMARY CANCER AND CANCER METASTASIS P2RY1, P2RX3, P2RY4 ADORA2B 16/4885ADORA2A 8/4885ADORA1 12/4885

“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.