SCHEMBL2056924

SCHEMBL2056924

C=CC1CCN(CCCCCCCCCCCCBr)C1=O

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
SCHEMBL633078 0.92 GBA1 (0.32)
SCHEMBL786721 0.86 FAAH (0.34)
SCHEMBL2922550 0.86 FAAH (0.34)
SCHEMBL787106 0.86 FAAH (0.34)
SCHEMBL4282749 0.84 GBA1 (0.43)
SCHEMBL369965 0.84 GBA1 (0.43)
SCHEMBL5303207 0.84 GBA1 (0.43)
SCHEMBL7355166 0.77 SMN1; SMN2 (0.32)
Water SCHEMBL28388741 0.76 ALDH1A1 (0.33)
SCHEMBL28513909 0.75 GBA1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3424965-B1 CROSSLINK AGENTS AND ITS USE BAUSCH & LOMB (US) 2020-05-13 EP disclosed
EP-3424965-A1 CROSSLINK AGENTS AND DUAL RADICAL CURE POLYMER Bausch & Lomb Incorporated (US) 2019-01-09 EP disclosed
EP-2167555-B1 CROSSLINK AGENTS AND DUAL RADICAL CURE POLYMER BAUSCH & LOMB (US) 2018-10-10 EP disclosed
US-8252850-B2 Crosslink agents BAUSCH & LOMB INCORPORATED (US) 2012-08-28 US disclosed
US-20110105779-A1 CROSSLINK AGENTS ORAPHARMA, INC. 2011-05-05 US disclosed
US-7901073-B2 Silicone hydrogel with composite hydrophilic and silicone polymers prepared with selective crosslink agents BAUSCH & LOMB INCORPORATED (US) 2011-03-08 US disclosed
EP-2167555-A1 CROSSLINK AGENTS AND DUAL RADICAL CURE POLYMER Bausch & Lomb Incorporated (US) 2010-03-31 EP disclosed
US-20090018233-A1 Crosslink Agents and Dual Radical Cure Polymer SOLTA MEDICAL, INC. 2009-01-15 US disclosed
WO-2009009527-A1 CROSSLINK AGENTS AND DUAL RADICAL CURE POLYMER BAUSCH & LOMB INCORPORATED (US) 2009-01-15 WO disclosed