SCHEMBL98977

SCHEMBL98977

CC[N+](CC)CC

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
SCHEMBL15612181 0.71
SCHEMBL5362781 0.71
SCHEMBL352063 0.62
SCHEMBL1363067 0.59
SCHEMBL15228676 0.59
Propane SCHEMBL1332979 0.58
SCHEMBL2336751 0.58
SCHEMBL31268649 0.58
Propane SCHEMBL1021 0.53
Propane SCHEMBL9248656 0.53 TSHR (0.43)

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 1471 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024098339-A1 POLYMER, PEROVSKITE SOLAR CELL, PHOTOVOLTAIC MODULE, AND ELECTRICAL DEVICE 宁德时代新能源科技股份有限公司 2024-05-16 WO claimed
CN-117904602-A Method for depositing conformal metal or metalloid silicon nitride films 弗萨姆材料美国有限责任公司 2024-04-19 CN claimed
CN-117038138-B Deep purification and boron resource recovery method for high-boron radioactive wastewater of nuclear power station 西南科技大学 2024-02-23 CN claimed
CN-114808002-B Electrode for carbon dioxide electroreduction and preparation method thereof 大连大学 2023-12-05 CN claimed
CN-117038138-A Deep purification and boron resource recovery method for high-boron radioactive wastewater of nuclear power station 西南科技大学 2023-11-10 CN claimed
US-20230348486-A1 NEAR-INFRARED EMITTING PORPHYRIN COMPOUND AND PREPARATION METHOD AND USE THEREOF PEKING UNIVERSITY (CN) 2023-11-02 US claimed
CN-115505001-A Degradable micromolecular biquaternary ammonium salt with high antibacterial activity, degradation product thereof, and synthesis and degradation methods thereof 中国人民大学 2022-12-23 CN claimed
CN-114808002-A Electrode for carbon dioxide electroreduction and preparation method thereof 大连大学 2022-07-29 CN claimed
US-20220017519-A1 7-BENZYL-4-(2-METHYLBENZYL)-2,4,6,7,8,9-HEXAHYDROIMIDAZO [1,2-a]PYRIDO[3,4-e]PYRIMIDIN-5(1H)-ONE, ANALOGS THEREOF, AND SALTS THEREOF AND METHODS FOR THEIR USE IN THERAPY JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2022-01-20 US claimed
CN-112279862-B Near-infrared porphyrin compound and preparation method and application thereof 北京大学 2022-01-11 CN claimed
EP-0763015-A1 SYSTEMATIC MODULAR PRODUCTION OF AMINIMIDE- AND OXAZOLONE- BASED MOLECULES HAVING AT LEAST TWO STRUCTURAL DIVERSITY ELEMENTS ARQULE, INC. (US) 1997-03-19 EP claimed
US-5496929-A MEDICAL DIAGNOSIS IMAGES FOR BRAINS AND BLOOD CIS BIO INTERNATIONAL (FR) 1996-03-05 US claimed
EP-0412542-B1 Cyclic neurokinin antagonists MERRELL DOW PHARMA (US) 1996-01-03 EP claimed
WO-1995032184-A1 SYSTEMATIC MODULAR PRODUCTION OF AMINIMIDE- AND OXAZOLONE- BASED MOLECULES HAVING AT LEAST TWO STRUCTURAL DIVERSITY ELEMENTS ARQULE, INC. (US) 1995-11-30 WO claimed
EP-0596037-A1 RADIOPHARMACEUTICAL PRODUCT HAVING IN PARTICULAR A CEREBRAL TROPISM COMPRISING A TRANSITION METAL NITRIDE COMPLEX, AND PREPARATION METHOD THEREFOR CIS BIO INTERNATIONAL (FR) 1994-05-11 EP claimed
WO-1993001839-A1 RADIOPHARMACEUTICAL PRODUCT HAVING IN PARTICULAR A CEREBRAL TROPISM COMPRISING A TRANSITION METAL NITRIDE COMPLEX, AND PREPARATION METHOD THEREFOR CIS BIO INTERNATIONAL (FR) 1993-02-04 WO claimed
US-4472309-A ANTIMICROBIAL FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US claimed
US-4408043-A POLYOXYALKYLENE HAVING FLUOROR AND CATIONIC NITROGEN GROUPS NALCO CHEMICAL COMPANY (US) 1983-10-04 US claimed
US-4100344-A BACTERICIDES E. R. SQUIBB & SONS, INC. (US) 1978-07-11 US claimed
US-4028354-A BACTERICIDES E. R. SQUIBB & SONS, INC. (US) 1977-06-07 US claimed