SCHEMBL3826724

SCHEMBL3826724

CCc1nc2ccccc2c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 2/20 1.00
PARP1 P09874 3/20 0.71
KMT2A Q03164 2/20 0.68
PDE10A Q9Y233 1/20 0.64
MAPT P10636 3/20 0.63
RAB9A P51151 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
GAA P10253 2/20 0.63
NPC1 O15118 1/20 0.63
MEN1 O00255 1/20 0.63
PARP2 Q9UGN5 1/20 0.62
POLB P06746 1/20 0.60
KDM4E B2RXH2 3/20 0.59
LMNA P02545 1/20 0.59
DDAH1 O94760 1/20 0.58
NPSR1 Q6W5P4 1/20 0.57
ALDH1A1 P00352 1/20 0.56
RET P07949 1/20 0.56
KDR P35968 1/20 0.56

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
SCHEMBL30176850 1.00 TNKS2 (1.00) TNKS2PARP1KMT2APDE10AMAPT
SCHEMBL5794718 0.86 PARP1 (0.82) TNKS2PARP1KMT2APDE10AMAPT
SCHEMBL29431542 0.86 PARP1 (0.82) TNKS2PARP1KMT2APDE10AMAPT
SCHEMBL16404338 0.85 PDE10A (0.84) TNKS2PARP1KMT2APDE10AMAPT
SCHEMBL168776 0.83 PARP1 (1.00) TNKS2PARP1KMT2APDE10ARAB9A
SCHEMBL29900512 0.83 PARP1 (1.00) TNKS2PARP1KMT2APDE10ARAB9A
SCHEMBL2999541 0.82 TNKS2 (0.69) TNKS2PARP1KMT2APDE10AMAPT
SCHEMBL1586541 0.82 PARP1 (0.91) TNKS2PARP1KMT2APDE10ARAB9A
SCHEMBL14266777 0.82 TNKS2 (0.69) TNKS2PARP1KMT2APDE10AMAPT
SCHEMBL1685046 0.82 TNKS2 (0.70) TNKS2PARP1KMT2APDE10AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357261-A1 ARYL HYDROCARBON RECEPTOR LIGANDS AND THEIR ANALOGUES FOR THE PREVENTION AND TREATMENT OF INFLAMMATORY DISORDERS The University of Pittsburgh- of the Commonwealth System of Higher Education 2023-11-09 US disclosed
US-20230357261-A1 ARYL HYDROCARBON RECEPTOR LIGANDS AND THEIR ANALOGUES FOR THE PREVENTION AND TREATMENT OF INFLAMMATORY DISORDERS The University of Pittsburgh- of the Commonwealth System of Higher Education 2023-11-09 US disclosed
CN-112174899-B Application of light-promoted Minisci C-H alkylation reaction in preparation of alkyl-substituted azacycle 南开大学 2023-01-17 CN disclosed
US-20220403383-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. 2022-12-22 US disclosed
WO-2022133551-A1 HISTONE DEACETYLASE INHIBITORS THE UNIVERSITY OF QUEENSLAND (AU) 2022-06-30 WO disclosed
US-20220017474-A1 Novel Polycyclic Compound EUTEC NEW MATERIALS TECHNOLOGY (SUZHOU) CO., LTD. (CN) 2022-01-20 US disclosed
CN-109384731-B Method for preparing quinazolinone from enol 南京理工大学 2021-10-08 CN disclosed
US-11021708-B2 Methods and compositions for modulating splicing SKYHAWK THERAPEUTICS, INC. (US) 2021-06-01 US disclosed
US-11008572-B2 Methods and compositions for modulating splicing SKYHAWK THERAPEUTICS, INC. (US) 2021-05-18 US disclosed
CN-112174899-A Application of light-promoted Minisci C-H alkylation reaction in preparation of alkyl-substituted azacycle 南开大学 2021-01-05 CN disclosed
US-6310069-B1 INTERMEDIATES TO AZOLIDINEDIONE ANTIDIABETIC COMPOUNDS SUCH AS 5-(4-(2-(2,4-DIMETHYL-6-OXO-1,6-DIHYDRO-1-PYRIMIDINYL)ETHOXY)PHENYL METHYL)THIAZOLIDINE-2,4-DIONES DR. REDDY'S RESEARCH FOUNDATION (IN) 2001-10-30 US disclosed
US-20010031759-A1 Novel heterocyclic compounds, process for their preparation and pharmaceutical compounds containing them and their use in the treatment of diabetes and related diseases DR. REDDY'S RESEARCH FOUNDATION & REDDY- CHEMINOR, INC. 2001-10-18 US disclosed
EP-1073643-A2 NEW HETEROCYCLIC COMPOUNDS AND THEIR USE IN MEDICINE, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 2001-02-07 EP disclosed
US-6114526-A REACTING AN AMINO DERIVATIVE WITH A HETEROCYCLIC DIONE COMPOUND TO FORM AN ANTIDIABETIC AGENT DR. REDDY'S RESEARCH FOUNDATION (IN) 2000-09-05 US disclosed
EP-0958296-A1 NOVEL HETEROCYCLIC COMPOUNDS PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED DISEASES DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-11-24 EP disclosed
US-5985884-A TREATMENT AND/OR PROPHYLAXIS OF DISEASES OR CONDITIONS IN WHICH INSULIN RESISTANCE IS THE UNDERLYING PATHOPHYSIOLOGICAL MECHANISM SUCH AS TYPE II DIABETES, IMPAIRED GLUCOSE TOLERANCE, DYSLIPIDAEMIA, HYPERTENSION, CORONARY HEART DISEASE DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-11-16 US disclosed
US-5885997-A Heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them and their use in the treatment of diabetes and related diseases DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-03-23 US disclosed
WO-1999008501-A2 NEW HETEROCYCLIC COMPOUNDS AND THEIR USE IN MEDICINE, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-02-25 WO disclosed
WO-1997041097-A2 NOVEL HETEROCYCLIC COMPOUNDS PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED DISEASES DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-11-06 WO disclosed
US-4283407-A ANTIHYPERTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-08-11 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 (6 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-20230357261-A1 ARYL HYDROCARBON RECEPTOR LIGANDS AND THEIR ANALOGUES FOR THE PREVENTION AND TREATMENT OF INFLAMMATORY DISORDERS AHR, ARNT, MTNR1A TNKS2 4224/4885PARP1 4174/4885KMT2A 2380/4885
US-11021708-B2 Methods and compositions for modulating splicing RBM17, SF3B1, SNRPA1 TNKS2 944/4885PARP1 1491/4885KMT2A 2256/4885
US-20220403383-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING RBM17, SF3B1, SNRPA1 TNKS2 944/4885PARP1 1491/4885KMT2A 2256/4885
US-11008572-B2 Methods and compositions for modulating splicing RBM17, SF3B1, SNRPA1 TNKS2 944/4885PARP1 1491/4885KMT2A 2256/4885
US-20220017474-A1 Novel Polycyclic Compound CUTA, DSG1, UACA TNKS2 1752/4885PARP1 399/4885KMT2A 2775/4885
US-20010031759-A1 Novel heterocyclic compounds, process for their preparation and pharmaceutical compounds containing them and their use in the treatment of diabetes and related diseases IAPP, GPR119, CYP11B1 TNKS2 2708/4885PARP1 4765/4885KMT2A 4666/4885

“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.