SCHEMBL63453

SCHEMBL63453

c1ncc2[nH]ccc2n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL29450178 1.00
SCHEMBL2079893 1.00 DYRK1A (0.41)
SCHEMBL20772033 0.98 DYRK1A (0.39)
SCHEMBL29259056 0.83 BRD4 (0.31)
SCHEMBL6002639 0.80 NUDT1 (0.62)
SCHEMBL29241305 0.80 METAP2 (0.32)
SCHEMBL30917344 0.74 TDO2 (0.39)
SCHEMBL27461853 0.72 EGFR (0.44)
SCHEMBL1940496 0.71 KDM4A (0.41)
SCHEMBL29624620 0.71 KDM4A (0.41)

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 2326 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2025-12-25 US claimed
WO-2025111431-A1 ANTI-CD7 ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF LES LABORATOIRES SERVIER (FR) 2025-05-30 WO claimed
WO-2025082069-A1 COMPOUND BINDING TO CRBN PROTEIN AND DEGRADATION AGENT OF PROTEIN 中国海洋大学 2025-04-24 WO claimed
EP-4525927-A1 ANTIBODY-DRUG CONJUGATES OF ANTINEOPLASTIC COMPOUNDS AND METHODS OF USE THEREOF Novartis AG (CH) 2025-03-26 EP claimed
CN-119032092-A Pyrazinone derivative and application thereof in medicine 西藏海思科制药有限公司 2024-11-26 CN claimed
CN-115246822-B Pyrimidine compound, and preparation method and application thereof 中国科学院上海药物研究所 2024-10-29 CN claimed
CN-116239597-B Pyrimidine pyrrole derivative and medicinal composition and application thereof 中国科学院上海药物研究所 2024-08-06 CN claimed
US-20240245699-A1 PYRROLE COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2024-07-25 US claimed
WO-2023225359-A1 ANTIBODY-DRUG CONJUGATES OF ANTINEOPLASTIC COMPOUNDS AND METHODS OF USE THEREOF NOVARTIS AG (CH) 2023-11-23 WO claimed
CN-114907387-B Pyrimido pyrrole KRAS inhibitor and preparation method and application thereof 中山大学 2023-11-10 CN claimed
CN-1646535-A Pyrrolopyrimidine derivative TEIJIN LTD (JP) 2005-07-27 CN claimed
CN-1196704-C Process for preparing nucleoside metabolism inhibitor and intermediate compound IND RES LTD (NZ) 2005-04-13 CN claimed
EP-1477490-A1 PYRROLOPYRIMIDINE DERIVATIVE TEIJIN LIMITED (JP) 2004-11-17 EP claimed
EP-1477489-A1 PYRROLOPYRIMIDINE DERIVATIVES TEIJIN LIMITED (JP) 2004-11-17 EP claimed
CN-1370171-A Process for preparing nucleoside metabolism inhibitors IND RES LTD (NZ) 2002-09-18 CN claimed
EP-0530579-B1 Condensed pyrimidine derivatives antitumor agents EISAI CO LTD (JP) 1998-11-11 EP claimed
US-5554615-A ANTITUMOR EISAI CO., LTD. (JP) 1996-09-10 US claimed
EP-0530579-A1 Condensed pyrimidine derivatives antitumor agents Eisai Co., Ltd. (JP) 1993-03-10 EP claimed
US-4871653-A DEVELOPING IN PRESENCE OF MERCAPTO POLYAZAINDENE PROMOTERS AND NUCLEATING QUATERNARY OR HYDRAZIDE-TYPE COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 1989-10-03 US claimed
EP-0071227-A1 Anti-leukemic beta-glycosyl C-nucleosides Sloan-Kettering Institute For Cancer Research (US) 1983-02-09 EP claimed