SCHEMBL5804646

SCHEMBL5804646

CCc1c[nH]c(C)c1

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
SCHEMBL20206944 0.79
SCHEMBL3538776 0.76
SCHEMBL891414 0.76
SCHEMBL23241465 0.76
SCHEMBL13233368 0.76
SCHEMBL3630370 0.74
SCHEMBL28199411 0.74
SCHEMBL29801086 0.74
SCHEMBL23862686 0.74 TP53 (0.54)
SCHEMBL12217552 0.74 DAO (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11224241-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2022-01-18 US claimed
US-11219232-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2022-01-11 US claimed
US-10327464-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2019-06-25 US claimed
US-10314325-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2019-06-11 US claimed
WO-2006063867-A2 SYMMETRICAL DIAZO COMPOUNDS CONTAINING 3-PYRIDINIUM GROUPS AND A NON-CATIONIC LINKER, COMPOSITIONS COMRISISNG THEM, METHOD OF COLOURING, AND DEVICE L'ORÉAL (FR) 2006-06-22 WO claimed
EP-2943072-B2 METHODS FOR AFFECTING THE FLAVOUR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC (US) 2025-04-30 EP disclosed
US-20240298681-A1 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC. 2024-09-12 US disclosed
CN-117417284-A Dipyrromethene oxalate, and preparation method and application thereof 云南大学 2024-01-19 CN disclosed
WO-2023237504-A1 HSD17B13 INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-12-14 WO disclosed
EP-4104682-A2 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOUR AND AROMA PROFILE OF CONSUMABLES Impossible Foods Inc. (US) 2022-12-21 EP disclosed
EP-3345484-B1 MEAT SUBSTITUTE AND METHOD FOR IMPARTING A BEEF-LIKE FLAVOUR TO A MEAT SUBSTITUTE IMPOSSIBLE FOODS INC (US) 2022-08-10 EP disclosed
CN-114436931-A Preparation method of N-substituted alkylated pyrrole derivative and application of N-substituted alkylated pyrrole derivative in cigarette flavoring 湖北中烟工业有限责任公司 2022-05-06 CN disclosed
WO-2014110532-A2 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOR AND AROMA PROFILE OF CONSUMABLES MARAXI, INC. (US) 2014-07-17 WO disclosed
US-20140073650-A1 PROTEASOME CHYMOTRYPSIN-LIKE INHIBITION USING PI-1833 ANALOGS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2014-03-13 US disclosed
US-20130190286-A1 B-RAF KINASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-07-25 US disclosed
US-8481549-B2 Dual-acting thiophene, pyrrole, thiazole and furan antihypertensive agents THERAVANCE, INC. (US) 2013-07-09 US disclosed
US-8314135-B2 Linked dibenzimidazole antivirals ENANTA PHARMACEUTICALS, INC. (US) 2012-11-20 US disclosed
US-20100266543-A1 LINKED DIBENZIMIDAZOLE ANTIVIRALS ENANTA PHARMACEUTICALS, INC. 2010-10-21 US disclosed
US-20100260715-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2010-10-14 US disclosed
WO-2006063867-A2 SYMMETRICAL DIAZO COMPOUNDS CONTAINING 3-PYRIDINIUM GROUPS AND A NON-CATIONIC LINKER, COMPOSITIONS COMRISISNG THEM, METHOD OF COLOURING, AND DEVICE L'ORÉAL (FR) 2006-06-22 WO disclosed