SCHEMBL2537084

SCHEMBL2537084

CC(C)(C)[Si](OS(=O)(=O)C(F)(F)F)(C(C)(C)C)C(C)(C)C

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
SCHEMBL12936595 0.80
SCHEMBL20337340 0.79 CA1 (0.32)
SCHEMBL10346389 0.78
SCHEMBL38009 0.78
SCHEMBL8719772 0.76
SCHEMBL38665372 0.75
SCHEMBL28527 0.74 CA1 (0.32)
SCHEMBL630962 0.74 CA1 (0.32)
SCHEMBL14777968 0.74 CA1 (0.32)
SCHEMBL22325672 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169277-B2 Epoxidation catalysts MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-27 US claimed
US-20140155634-A1 EPOXIDATION CATALYSTS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-06-05 US claimed
US-8680303-B2 Epoxidation catalysts MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-03-25 US claimed
US-20110257415-A1 EPOXIDATION CATALYSTS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2011-10-20 US claimed
WO-2007027752-A1 CATALYTIC REACTIONS INVOLVING ALKENES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2007-03-08 WO claimed
CN-118878619-B Eucalactam B preparation method 深圳乾延药物研发科技有限公司 2025-01-10 CN disclosed
US-20240239761-A1 BICYCLIC PHENOL COMPOUNDS AND USE THEREOF MEDSHINE DISCOVERY INC. (CN) 2024-07-18 US disclosed
US-9169277-B2 Epoxidation catalysts MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-27 US disclosed
US-20140155634-A1 EPOXIDATION CATALYSTS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-06-05 US disclosed
US-8680303-B2 Epoxidation catalysts MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-03-25 US disclosed
US-8314246-B2 Catalytic reactions involving alkenes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-11-20 US disclosed
US-20110257415-A1 EPOXIDATION CATALYSTS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2011-10-20 US disclosed
US-20090216025-A1 Catalytic reactions involving alkenes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-08-27 US disclosed