SCHEMBL6546263

SCHEMBL6546263

Nn1c2c(=O)ccc(=O)c1=2

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
SCHEMBL4586117 0.67 KDM4E (0.38)
SCHEMBL19284434 0.60
SCHEMBL1959323 0.57 PAX8 (0.32)
SCHEMBL13078908 0.57
SCHEMBL17718561 0.55 KDM4E (0.31)
SCHEMBL17233963 0.53
SCHEMBL29690329 0.52 S100A4 (0.30)
SCHEMBL28809285 0.52 ALOX15 (0.30)
SCHEMBL25299764 0.50 PAX8 (0.33)
SCHEMBL18898143 0.50

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4058607-A DIHALOVINYL DIALKYL PHOSPHATE, 1,3-BENZODIOXOLES AIRWICK INDUSTRIES, INC. (US) 1977-11-15 US claimed
US-3966900-A INSECTICIDES AIRWICK INDUSTRIES, INC. (US) 1976-06-29 US claimed
EP-2892500-B1 USE OF SPIDER VENOMS FOR SKIN WHITENING/DEPIGMENTING AND COMPOSITION COMPRISING SPIDER VENOMS MOLECULES OR SYNTHETIC ANALOGS LABORATOIRE INOYA (FR) 2019-05-08 EP disclosed
US-10064814-B2 Use of spider venoms for skin whitening/depigmenting and composition comprising spider venoms molecules or synthetic analogs LABORATOIRE IN'OYA (FR) 2018-09-04 US disclosed
US-20150231061-A1 USE OF SPIDER VENOMS FOR SKIN WHITENING/DEPIGMENTING AND COMPOSITION COMPRISING SPIDER VENOMS MOLECULES OR SYNTHETIC ANALOGS LABORATOIRE IN'OYA (FR) 2015-08-20 US disclosed
EP-2892500-A2 USE OF SPIDER VENOMS FOR SKIN WHITENING/DEPIGMENTING AND COMPOSITION COMPRISING SPIDER VENOMS MOLECULES OR SYNTHETIC ANALOGS Laboratoire In'Oya (FR) 2015-07-15 EP disclosed
WO-2014037111-A2 USE OF SPIDER VENOMS FOR SKIN WHITENING/DEPIGMENTING AND COMPOSITION COMPRISING SPIDER VENOMS MOLECULES OR SYNTHETIC ANALOGS LABORATOIRE IN'OYA (FR) 2014-03-13 WO disclosed
EP-2705830-A1 Use of spider venoms for skin whitening/depigmentating and composition comprising spider venoms derivatives Laboratoire In'Oya SAS (FR) 2014-03-12 EP disclosed
EP-1095018-B1 AMINOIMINOQUINONE AND AMINOQUINONE ALKALOID COMPOUNDS AS CASPASE INHIBITORS HARBOR BRANCH OCEANOGRAPHIC (US) 2004-01-14 EP disclosed
US-6218419-B1 USED AS ANTINFLAMMATORY, ANTI-PROLIFERATIVE, IMMUNOMODULATORY, AND/OR NEUROPROTECTIVE AGENTS HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. 2001-04-17 US disclosed
US-6218419-B1 USED AS ANTINFLAMMATORY, ANTI-PROLIFERATIVE, IMMUNOMODULATORY, AND/OR NEUROPROTECTIVE AGENTS HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. 2001-04-17 US disclosed