SCHEMBL420893

SCHEMBL420893

C=C1CC[CH]CC1

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
SCHEMBL766976 0.79
SCHEMBL9335399 0.79
SCHEMBL7492457 0.72
SCHEMBL5248666 0.69
SCHEMBL3440747 0.69
SCHEMBL11074596 0.69
SCHEMBL239887 0.69
Ammonia Solution, Strong SCHEMBL20838553 0.65
SCHEMBL42375 0.63
SCHEMBL1403443 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113999206-B Isoquinoline-1, 3-diamine analogue, preparation method, pharmaceutical composition and application thereof 北京鑫开元医药科技有限公司 2022-04-12 CN claimed
CN-113999206-A Isoquinoline-1, 3-diamine analogue, preparation method, pharmaceutical composition and application thereof 北京鑫开元医药科技有限公司 2022-02-01 CN claimed
US-11083710-B2 PSMA binding ligand-linker conjugates and methods for using PURDUE RESEARCH FOUNDATION (US) 2021-08-10 US claimed
US-20200155696-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2020-05-21 US claimed
US-20200155695-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2020-05-21 US claimed
US-20040072964-A1 Vinyl ether resins for structural applications DSM IP ASSETS B.V. (NL) 2004-04-15 US claimed
EP-0640142-B1 PROCESS FOR PRODUCTION OF AVERMECTINS AND CULTURES THEREFOR PFIZER (US) 1998-05-20 EP claimed
US-5576199-A CULTURE OF STREPTOMYCES UNDER AEROBIC CONDITIONS IN NUTRIENTS PFIZER INC. (US) 1996-11-19 US claimed
EP-0640142-A1 PROCESS FOR PRODUCTION OF AVERMECTINS AND CULTURES THEREFOR PFIZER INC. (US) 1995-03-01 EP claimed
EP-0276103-B1 Process for production of B avermectins and cultures therefor PFIZER (US) 1993-10-20 EP claimed
WO-1993019194-A1 PROCESS FOR PRODUCTION OF AVERMECTINS AND CULTURES THEREFOR PFIZER INC. (US) 1993-09-30 WO claimed
EP-0284176-B1 PROCESS FOR PRODUCTION OF AVERMECTINS AND CULTURES THEREFOR PFIZER INC. (US) 1993-08-25 EP claimed
EP-0313297-B1 PROCESS FOR PRODUCTION OF AVERMECTIN AGLYCONES AND CULTURES THEREFOR PFIZER INC. (US) 1993-05-19 EP claimed
EP-0276131-B1 NON-NATURAL DEMETHYLAVERMECTINS AND PROCESS THEREFOR PFIZER INC. (US) 1993-04-07 EP claimed
EP-0313297-A2 Process for production of avermectin aglycones and cultures therefor PFIZER INC. (US) 1989-04-26 EP claimed
US-4816452-A ANTIBIOTICS BEECHAM GROUP P.L.C. (GB) 1989-03-28 US claimed
EP-0284176-A2 Process for production of avermectins and cultures therefor PFIZER INC. (US) 1988-09-28 EP claimed
EP-0276103-A2 Process for production of B avermectins and cultures therefor PFIZER INC. (US) 1988-07-27 EP claimed
EP-0276131-A2 Non-natural demethylavermectins and process therefor PFIZER INC. (US) 1988-07-27 EP claimed
EP-0210815-A2 6-Beta-(alpha-etherified oxyimino)-acylamino penicillanic-acid derivatives, their preparation and use BEECHAM GROUP PLC (GB) 1987-02-04 EP claimed