SCHEMBL55652

SCHEMBL55652

[C]1=NNc2ccccc2C=C1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL18935280 0.70 GAA (0.36) GAAMAPT
SCHEMBL8855 0.67 GAA (0.48) GAAMAPT
SCHEMBL452418 0.67 GAA (0.48) GAAMAPT
Benzodiazepine SCHEMBL8137 0.64 GAA (0.44) GAAMAPT
SCHEMBL2299949 0.64 GAA (0.44) GAAMAPT
SCHEMBL208462 0.64 GAA (0.44) GAAMAPT
Benzodiazepine SCHEMBL7160172 0.64 GAA (0.44) GAAMAPT
SCHEMBL9934042 0.63 GAA (0.43) GAAMAPT
SCHEMBL11428738 0.62 GAA (0.48) GAAMAPT
SCHEMBL2386480 0.62 MAPT (0.48) GAAMAPT

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 1568 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240109847-A1 HISTONE DEACETYLASE INHIBITORS THE UNIVERSITY OF QUEENSLAND (AU) 2024-04-04 US claimed
EP-4267539-A1 HISTONE DEACETYLASE INHIBITORS The University of Queensland (AU) 2023-11-01 EP claimed
CN-109326731-B Organic light emitting device and electronic apparatus including the same 三星显示有限公司 2023-04-28 CN claimed
US-20220409629-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING A RESPIRATORY SYNCYTIAL VIRUS (RSV) INFECTION PFIZER INC. 2022-12-29 US claimed
EP-4051675-A1 PHARMACEUTICAL COMPOUNDS Reviral Limited (GB) 2022-09-07 EP claimed
EP-4048665-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING A RESPIRATORY SYNCYTIAL VIRUS (RSV) INFECTION Reviral Limited (GB) 2022-08-31 EP claimed
WO-2022133551-A1 HISTONE DEACETYLASE INHIBITORS THE UNIVERSITY OF QUEENSLAND (AU) 2022-06-30 WO claimed
EP-4017856-A1 PHARMACEUTICAL COMPOUNDS Reviral Limited (GB) 2022-06-29 EP claimed
EP-3662751-B1 PYRAZOLO[4,3-C]QUINOLINE DERIVATIVES FOR INHIBITION OF B-GLUCURONIDASE UNIV KAOHSIUNG MEDICAL (TW) 2021-10-13 EP claimed
CN-107903208-B Biaryl pyridine deubiquitinase inhibitor, preparation method and application thereof 杭州市西溪医院 2021-09-03 CN claimed
WO-2002083680-A1 NOVEL TRICYCLIC HYDROXY CARBOXAMIDES AND DERIVATIVES THEREOF TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS WYETH (US) 2002-10-24 WO claimed
US-6432964-B1 A THIENYLPYRIMIDINE COMPOUND AGREVO UK LIMITED (GB) 2002-08-13 US claimed
WO-2002030426-A1 AZA- AND POLYAZA-NAPHTHALENYL-CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2002-04-18 WO claimed
EP-1051415-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-15 EP claimed
EP-1042315-A1 CYCLIC IMIDE-SUBSTITUTED PYRIDYLALKANE, ALKENE, AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS Klinge Pharma GmbH (DE) 2000-10-11 EP claimed
CN-1234801-A 3-carboxamide derivatives of 5H-pyrrolo [2, 1-C ] [1,4] -benzodiazepine * AMERICAN HOME PROD (US) 1999-11-10 CN claimed
WO-1999037637-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-07-29 WO claimed
WO-1999031087-A1 CYCLIC IMIDE-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS KLINGE PHARMA GMBH (DE) 1999-06-24 WO claimed
US-5391772-A In presence of a dry aprotic solvent and proton acceptor MERCK & CO., INC. (US) 1995-02-21 US claimed
WO-1995001970-A1 ALCOHOL TO AZIDE SN2 CONVERSION MERCK & CO., INC. (US) 1995-01-19 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20220409629-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING A RESPIRATORY SYNCYTIAL VIRUS (RSV) INFECTION GABRA1, GABRA3, CNR1 GAA 4576/4885MAPT 3785/4885
US-20240109847-A1 HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC3, HDAC11 GAA 79/4885MAPT 2058/4885

“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.