SCHEMBL4069386

SCHEMBL4069386

C1CNC2NCCC2C1

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
SCHEMBL215050 0.94 ALDH1A1 (0.35)
SCHEMBL4070075 0.92 ALDH1A1 (0.37)
SCHEMBL28172935 0.88 ALDH1A1 (0.39)
SCHEMBL473647 0.87
SCHEMBL26462174 0.82 ALDH1A1 (0.39)
SCHEMBL15525589 0.80
SCHEMBL17424767 0.79
SCHEMBL10738266 0.79 ALDH1A1 (0.41)
SCHEMBL20384045 0.73
SCHEMBL446920 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024166133-A1 LIGAND SCAFFOLD FOR PROXIMAL &amp; REMOTE BORYLATION OF ARENES CENTRE OF BIOMEDICAL RESEARCH (IN) 2024-08-15 WO disclosed
US-11312668-B2 Organic reactions carried out in aqueous solution in the presence of a hydroxyalkyl(alkyl)cellulose or an alkylcellulose ABBVIE INC. (US) 2022-04-26 US disclosed
US-20210017100-A1 ORGANIC REACTIONS CARRIED OUT IN AQUEOUS SOLUTION IN THE PRESENCE OF A HYDROXYALKYL(ALKYL)CELLULOSE OR AN ALKYLCELLULOSE AbbVie Deutschland GmbH & Co. KG (DE) 2021-01-21 US disclosed
US-10836688-B2 Organic reactions carried out in aqueous solution in the presence of a hydroxyalkyl(alkyl)cellulose or an alkylcellulose ABBVIE INC. (US) 2020-11-17 US disclosed
US-10683256-B2 Process for preparing substituted biphenyls BASF SE (DE) 2020-06-16 US disclosed
US-20200148610-A1 ORGANIC REACTIONS CARRIED OUT IN AQUEOUS SOLUTION IN THE PRESENCE OF A HYDROXYALKYL(ALKYL)CELLULOSE OR AN ALKYLCELLULOSE ABBVIE INC. 2020-05-14 US disclosed
WO-2019174533-A1 SMALL MOLECULE PD-1/PD-L1 INHIBITOR AND USE THEREOF IN DRUGS 广东东阳光药业有限公司 2019-09-19 WO disclosed
US-10407383-B2 Cyclopentene and cyclopentadiene compounds for controlling invertebrate pests BASF SE (DE) 2019-09-10 US disclosed
US-20190210954-A1 Process for Preparing Substituted Biphenyls LIANHE CHEMICAL TECHNOLOGY CO., LTD (CN) 2019-07-11 US disclosed
US-10327446-B2 Naphthyl- or isoquinolinyl-substituted isothiazoline compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2019-06-25 US disclosed
EP-2055705-A1 COMPOUND HAVING CYCLIC GROUP BOUND THERETO THROUGH SPIRO BINDING AND USE THEREOF Ono Pharmaceutical CO., LTD. (JP) 2009-05-06 EP disclosed
US-20090105297-A1 Compounds Modulating C-Kit Activity PLEXXIKON INC 2009-04-23 US disclosed
US-7498342-B2 Compounds modulating c-kit activity PLEXXIKON, INC. (US) 2009-03-03 US disclosed
EP-1083881-B1 LIPOSOME COMPOSITIONs containing a quinolone derivative AND their use as antibacterial agents ALZA CORP (US) 2004-08-25 EP disclosed
EP-1176962-B1 LIPOSOME COMPOSITIONS FOR IMPROVED DRUG RETENTION ALZA CORP (US) 2004-02-11 EP disclosed
EP-1176962-A2 LIPOSOME COMPOSITIONS FOR IMPROVED DRUG RETENTION Alza Corporation (US) 2002-02-06 EP disclosed
EP-1083881-A2 LIPOSOME COMPOSITION AND METHOD FOR ADMINISTERING A QUINOLONE ALZA Corporation (US) 2001-03-21 EP disclosed
WO-2000066126-A2 LIPOSOME COMPOSITIONS FOR IMPROVED DRUG RETENTION ALZA CORPORATION (US) 2000-11-09 WO disclosed
US-5972379-A LIPOSOMES HAVING A SURFACE COATING OF HYDROPHILIC POLYMER CHAINS AND AN ENTRAPPED CIPROFLOXACIN-AMINO ACID CONJUGATE, USEFUL FOR TREATING THE BACTERIAL INFECTIONS SEQUUS PHARMACEUTICALS, INC. (US) 1999-10-26 US disclosed
WO-1999051202-A2 QUINOLONE CONTAINING LIPOSOMES AND THEIR USE AS ANTIBACTERIAL AGENTS SEQUUS PHARMACEUTICALS, INC. (US) 1999-10-14 WO disclosed