SCHEMBL3387249

SCHEMBL3387249

[CH2]c1occc1C

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
SCHEMBL115390 0.69
Hydrochloric Acid SCHEMBL29135193 0.67
SCHEMBL2389558 0.65
SCHEMBL183124 0.65
SCHEMBL2966580 0.65
SCHEMBL624509 0.65
SCHEMBL12151288 0.65
SCHEMBL2959506 0.65
SCHEMBL5609587 0.65
SCHEMBL5312705 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4273147-A1 SUBSTITUTED SPIROLACTAMS, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2023-11-08 EP claimed
EP-4178959-A1 NITROGEN HETEROCYCLIC CYTOKININ DERIVATIVES, COMPOSITIONS CONTAINING THESE DERIVATIVES AND USE THEREOF Univerzita Palackého v Olomouci (CZ) 2023-05-17 EP claimed
US-11643413-B2 9-(2-oxacycloalkyl)-9H-purine-2,6-diamine derivatives and their use for the treatment of skin disorders UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2023-05-09 US claimed
EP-3615535-B1 9-(2-OXACYCLOALKYL)-9H-PURINE-2,6-DIAMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF SKIN DISORDERS UNIV PALACKEHO (CZ) 2022-06-15 EP claimed
WO-2022012702-A1 NITROGEN HETEROCYCLIC CYTOKININ DERIVATIVES, COMPOSITIONS CONTAINING THESE DERIVATIVES AND USE THEREOF UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2022-01-20 WO claimed
US-20200157105-A1 9-(2-OXACYCLOALKYL)-9H-PURINE-2,6-DIAMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF SKIN DISORDERS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2020-05-21 US claimed
EP-3615535-A1 9-(2-OXACYCLOALKYL)-9H-PURINE-2,6-DIAMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF SKIN DISORDERS Univerzita Palackého v Olomouci (CZ) 2020-03-04 EP claimed
EP-3452635-B1 PROCESS FOR DEPOSITING A METAL OR METAL ALLOY ON A SURFACE OF A SUBSTRATE INCLUDING ITS ACTIVATION ATOTECH DEUTSCHLAND GMBH (DE) 2020-02-26 EP claimed
WO-2018196893-A1 9-(2-OXACYCLOALKYL)-9H-PURINE-2,6-DIAMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF SKIN DISORDERS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2018-11-01 WO claimed
CN-105994477-A Pumpkin-cake raw materials used for 3D printing 庞用 2016-10-12 CN claimed
CN-105831369-A Preparation method of chocolate with cocoa butter alternatives for 3D printing 广西筑梦三体科技有限公司 2016-08-10 CN claimed
CN-105815365-A Hawthorn cake raw material used for 3D printing 庞用 2016-08-03 CN claimed
CN-105815518-A Preparation method of novel palmin type chocolate for 3D printing 广西筑梦三体科技有限公司 2016-08-03 CN claimed
CN-105815366-A Chestnut cake raw material used for 3D printing 庞用 2016-08-03 CN claimed
CN-105767407-A Pure cocoa butter type chocolate for 3D printing 广西筑梦三体科技有限公司 2016-07-20 CN claimed
CN-105767411-A New chocolate for 3D printing 南宁梦幻三体环保科技有限公司 2016-07-20 CN claimed
CN-105767410-A Preparation method of pure cocoa butter type chocolate for 3D printing 广西筑梦三体科技有限公司 2016-07-20 CN claimed
CN-105767408-A Preparation method of new chocolate for 3D printing 广西筑梦三体科技有限公司 2016-07-20 CN claimed
CN-105724706-A Cocoa butter substitute type chocolate for 3D printing 广西筑梦三体科技有限公司 2016-07-06 CN claimed
WO-1995000040-A1 STABILISING VOLATILE FLAVOURINGS FIRMENICH SA (CH) 1995-01-05 WO claimed