SCHEMBL309452

SCHEMBL309452

CCCc1cnccn1

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
SCHEMBL30390174 1.00
Ethane SCHEMBL28701355 0.98 CYP3A4 (0.39)
SCHEMBL379178 0.88 PDCD1 (0.36)
SCHEMBL4412197 0.86 CYP2D6 (0.43)
SCHEMBL31091496 0.85 TLR7 (0.42)
SCHEMBL1325052 0.85 TDP1 (0.48)
SCHEMBL19304404 0.83 TDP1 (0.47)
SCHEMBL16115136 0.83 TDP1 (0.47)
SCHEMBL15376927 0.83 TDP1 (0.47)
SCHEMBL5138548 0.83 TDP1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260096585-A1 ORAL COMPOSITION KAO CORPORATION (JP) 2026-04-09 US claimed
EP-4591720-A1 ORAL COMPOSITION Kao Corporation (JP) 2025-07-30 EP claimed
CN-120041253-A Incense base for increasing aroma characteristics of nuts of cigarettes and preparation method and application thereof 江苏中烟工业有限责任公司 2025-05-27 CN claimed
CN-119744164-A Odor and colorant stable compositions 西姆莱斯股份公司 2025-04-01 CN claimed
CN-119655345-A Coffee replica made from a single component 航行食品股份有限公司 2025-03-21 CN claimed
CN-119009136-A Pyrazinyl eutectic electrolyte with wide electrochemical stability window, and preparation method and application thereof 中国科学院长春应用化学研究所 2024-11-22 CN claimed
CN-118914433-A Method for simultaneously separating multiple groups of isomers and quantitatively detecting 24 pyrazine compounds 泸州品创科技有限公司 2024-11-08 CN claimed
CN-118716675-A Preparation method of atomized liquid spice, atomized liquid spice and atomized liquid 深圳麦克韦尔科技有限公司 2024-10-01 CN claimed
CN-118338791-A Aldehyde mixtures for improved flavor 西姆莱斯有限公司 2024-07-12 CN claimed
WO-2024063038-A1 ORAL COMPOSITION 花王株式会社 2024-03-28 WO claimed
WO-2010131147-A1 CYCLOBUTENEDIONE DERIVATIVES PFIZER LIMITED (GB) 2010-11-18 WO claimed
WO-2010131145-A1 CYCLOBUTENEDIONE DERIVATIVES PFIZER LIMITED (GB) 2010-11-18 WO claimed
WO-2010131146-A1 CYCLOBUTENEDIONE DERIVATIVES PFIZER LIMITED (GB) 2010-11-18 WO claimed
WO-2010107969-A1 IMPROVED CHEMICAL SYNTHESIS OF DIAZAINDOLES BY CHICHIBABIN CYCLIZATION SANOFI-AVENTIS (FR) 2010-09-23 WO claimed
WO-2010030196-A1 TRANSFORMATION OF BIOMASS MILLER IAN JAMES (NZ) 2010-03-18 WO claimed
US-7674781-B2 Hyaluronic acid-retaining polymers SHEARDOWN HEATHER 2010-03-09 US claimed
US-7030450-B2 Precursor for hafnium oxide layer and method for forming halnium oxide film using the precursor SAMSUNG ELECTRONICS CO., LTD. (KR) 2006-04-18 US claimed
US-20040113195-A1 Precursor for hafnium oxide layer and method for forming halnium oxide film using the precursor SAMSUNG ELECTRONICS CO., LTD. (KR) 2004-06-17 US claimed
EP-1394164-A1 Precursor containing a nitrogen compound bound to HfCl4 for hafnium oxide layer and method for forming hafnium oxide film using the precursor Samsung Electronics Co., Ltd. (KR) 2004-03-03 EP claimed
US-4303689-A Flavoring with pyrazine derivatives FIRMENICH SA (CH) 1981-12-01 US claimed