SCHEMBL3426095

SCHEMBL3426095

[CH2]CCOC(CC)OCCC

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
SCHEMBL3032689 0.87 CA1 (0.33)
SCHEMBL1648071 0.80
SCHEMBL6374803 0.79 THRB (0.38)
SCHEMBL11211511 0.77 LMNA (0.41)
SCHEMBL6375692 0.77 ADRB2 (0.38)
SCHEMBL9144601 0.77
SCHEMBL7831603 0.76 CA1 (0.31)
SCHEMBL6021422 0.75 HSD17B10 (0.31)
SCHEMBL14836168 0.75 DNM1 (0.45)
SCHEMBL439942 0.74

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-2554537-B1 METHOD FOR PRODUCING CARBAMATE COMPOUND, CARBAMATE COMPOUND, AND METHOD FOR PRODUCING ISOCYANATE COMPOUND USING SAME AGC INC (JP) 2018-10-31 EP disclosed
US-9260383-B2 Method for producing carbamate compound, carbamate compound, and method for producing isocyanate compound using same ASAHI GLASS COMPANY, LIMITED (JP) 2016-02-16 US disclosed
US-20150087854-A1 METHOD FOR PRODUCING CARBAMATE COMPOUND, CARBAMATE COMPOUND, AND METHOD FOR PRODUCING ISOCYANATE COMPOUND USING SAME AGC Inc. (JP) 2015-03-26 US disclosed
US-8927756-B2 Method for producing carbamate compound, carbamate compound, and method for producing isocyanate compound using same ASAHI GLASS COMPANY, LIMITED (JP) 2015-01-06 US disclosed
EP-2218708-B1 METHOD FOR PRODUCING CARBONATE COMPOUND ASAHI GLASS CO LTD (JP) 2014-06-25 EP disclosed
EP-2554537-A1 METHOD FOR PRODUCING CARBAMATE COMPOUND, CARBAMATE COMPOUND, AND METHOD FOR PRODUCING ISOCYANATE COMPOUND USING SAME Asahi Glass Company, Limited (JP) 2013-02-06 EP disclosed
US-20130023691-A1 METHOD FOR PRODUCING CARBAMATE COMPOUND, CARBAMATE COMPOUND, AND METHOD FOR PRODUCING ISOCYANATE COMPOUND USING SAME AGC Inc. (JP) 2013-01-24 US disclosed
US-20100240912-A1 METHOD FOR PRODUCING CARBONATE COMPOUND ASAHI GLASS COMPANY, LIMITED 2010-09-23 US disclosed
EP-2218708-A1 METHOD FOR PRODUCING CARBONATE COMPOUND Asahi Glass Co., Ltd. (JP) 2010-08-18 EP disclosed