SCHEMBL178520

SCHEMBL178520

CCc1cncn1C

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
Bromide SCHEMBL15090436 0.98
Hydrochloric Acid SCHEMBL27926323 0.98
SCHEMBL12723096 0.84
SCHEMBL906337 0.83
SCHEMBL10425365 0.82 CHRM5 (0.43)
SCHEMBL27908297 0.82 CHRM5 (0.38)
SCHEMBL27908303 0.82 CHRM5 (0.38)
SCHEMBL4300091 0.81
SCHEMBL12722883 0.81
SCHEMBL27891388 0.80 CHRM5 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100443173-C Catalyst system for synthetizing acetic acid from methanol or synthetizing ethylanhydride from methyl acetate and use thereof CHINESE ACAD INST CHEMISTRY (CN) 2008-12-17 CN claimed
JP-2006518774-A 2006-08-17 JP claimed
CN-1778469-A Catalyst system for synthetizing acetic acid from methanol or synthetizing ethylanhydride from methyl acetate and use thereof CHINESE ACAD INST CHEMISTRY (CN) 2006-05-31 CN claimed
WO-2005023933-A1 THERMOSETTING RESIN COMPOSITION FOR HIGH SPEED TRANSMISSION CIRCUIT BOARD LG CHEM, LTD. (KR) 2005-03-17 WO claimed
WO-2024089049-A1 MODULATORS OF SORTILIN ACTIVITY INSUSENSE ApS (DK) 2024-05-02 WO disclosed
US-11912686-B2 LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2024-02-27 US disclosed
US-20230348424-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE SCHRÖDINGER, INC. 2023-11-02 US disclosed
US-20230348424-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE SCHRÖDINGER, INC. 2023-11-02 US disclosed
US-20230339900-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2023-10-26 US disclosed
US-20230285578-A1 PTH ANALOGS FOR THE TREATMENT OF HYPOPARATHYROIDISM INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2023-09-14 US disclosed
WO-2023164235-A1 COMPOUNDS AND METHODS USEFUL FOR STABILIZING PHENYLALANINE HYDROXYLASE MUTATIONS AGIOS PHARMACEUTICALS, INC. (US) 2023-08-31 WO disclosed
US-20230271961-A1 Pan-Tropic Entry Inhibitors UNIV EMORY (US) 2023-08-31 US disclosed
US-7189502-B1 Radiographic materials with antifoggant precursors EASTMAN KODAK COMPANY (US) 2007-03-13 US disclosed
US-7189502-B1 Radiographic materials with antifoggant precursors EASTMAN KODAK COMPANY (US) 2007-03-13 US disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
US-7186841-B2 (2-imidazolyl)quinolin-4-yl aldehydes; immunomodulators, antiproliferative agents; metabolic disorders AMGEN INC. (US) 2007-03-06 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 US disclosed
CN-1778469-A Catalyst system for synthetizing acetic acid from methanol or synthetizing ethylanhydride from methyl acetate and use thereof CHINESE ACAD INST CHEMISTRY (CN) 2006-05-31 CN disclosed
CN-1669100-A Electrolyte for electrochemical capacitor and electrochemical capacitor containing the same SANYO CHEMICAL IND LTD (JP) 2005-09-14 CN disclosed
WO-2005023933-A1 THERMOSETTING RESIN COMPOSITION FOR HIGH SPEED TRANSMISSION CIRCUIT BOARD LG CHEM, LTD. (KR) 2005-03-17 WO disclosed