SCHEMBL4119803

SCHEMBL4119803

C=CCN[CH]CCCC

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
SCHEMBL8909344 0.93 TSHR (0.52)
SCHEMBL7119890 0.85
SCHEMBL1485881 0.77 TSHR (0.48)
SCHEMBL1485879 0.77 TSHR (0.48)
SCHEMBL6280915 0.77 TSHR (0.48)
SCHEMBL175321 0.74
SCHEMBL646484 0.74
SCHEMBL387510 0.72
SCHEMBL3035311 0.72 ADH1B (0.52)
SCHEMBL11142797 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3640248-B1 AMINOPYRIMIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING ADAMADLE BIOTECHNOLOGY LLC (CN) 2023-08-23 EP claimed
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof Beijing Adamadle Biotechnology Limited Liability Company (CN) 2022-06-07 US claimed
EP-3640248-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Adamadle Biotechnology Limited Liability Company (CN) 2020-04-22 EP claimed
US-20200087296-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Adamadle Biotechnology Limited Liability Company (CN) 2020-03-19 US claimed
WO-2019154366-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 江苏奥赛康药业有限公司 2019-08-15 WO claimed
CN-104797581-A HETEROARYL ALKYNE COMPOUND AND APPLICATION THEREOF NANJING SANHOME PHARMACEUTICAL CO LTD 2015-07-22 CN claimed
CN-1832920-A Aryl and heteroaryl compounds, compositions, and methods of use TRANSTECH PHARMA INC (US) 2006-09-13 CN claimed
EP-1660439-A2 ARYL AND HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE Transtech Pharma, Inc. (US) 2006-05-31 EP claimed
US-20050059705-A1 Aryl and heteroaryl compounds, compositions, and methods of use VTVX HOLDINGS I LLC 2005-03-17 US claimed
WO-2005014533-A2 ARYL AND HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE TRANSTECH PHARMA, INC. (US) 2005-02-17 WO claimed
EP-0378767-B1 Method for the oligomerisation of hexafluoropropene oxide HOECHST AG (DE) 1994-08-31 EP claimed
EP-0246114-B1 PHOTOCHROMIC SPIROPYRAN COMPOUNDS GEC-MARCONI LIMITED (GB) 1992-09-02 EP claimed
US-4973748-A PERFLUOROCARBONYL FLUORIDES HOECHST AKTIENGESELLSCHAFT (DE) 1990-11-27 US claimed
US-4826977-A Photochromic spiropyran compounds THE PLESSEY COMPANY PLC (GB) 1989-05-02 US claimed
EP-0246114-A2 Photochromic spiropyran compounds GEC-MARCONI LIMITED (GB) 1987-11-19 EP claimed
EP-3640248-B1 AMINOPYRIMIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING ADAMADLE BIOTECHNOLOGY LLC (CN) 2023-08-23 EP disclosed
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof Beijing Adamadle Biotechnology Limited Liability Company (CN) 2022-06-07 US disclosed
US-4820694-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1989-04-11 US disclosed
EP-0262903-A2 New acyl derivatives of 20-modified tylosin and desmycosin compounds ELI LILLY AND COMPANY (US) 1988-04-06 EP disclosed
EP-0262905-A2 Modifications of 3-0-demethyl-mycinose in macrocin and lactenocin ELI LILLY AND COMPANY (US) 1988-04-06 EP disclosed