SCHEMBL249855

SCHEMBL249855

CN(C)C=C(F)C#N

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
SCHEMBL249854 1.00
SCHEMBL26999620 0.72
SCHEMBL148424 0.71
SCHEMBL21184103 0.69
SCHEMBL264678 0.69
SCHEMBL4594308 0.67
SCHEMBL10413780 0.67
SCHEMBL4594305 0.67
SCHEMBL21028702 0.65
SCHEMBL24056630 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107793364-A A kind of method for synthesizing 5 Flucytosines 新乡拓新药业股份有限公司 2018-03-13 CN claimed
US-20250243177-A1 sGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2025-07-31 US disclosed
CN-107021951-B sGC stimulators 赛克里翁治疗有限公司 2020-10-20 CN disclosed
CN-110105290-B Preparation method of 5-fluorocytosine 浙江伟锋药业有限公司 2020-06-23 CN disclosed
US-20190345130-A1 SGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2019-11-14 US disclosed
CN-110105290-A A kind of preparation method of 5-flurocytosine 浙江伟锋药业有限公司 2019-08-09 CN disclosed
US-10189809-B2 SGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2019-01-29 US disclosed
CN-107793364-A A kind of method for synthesizing 5 Flucytosines 新乡拓新药业股份有限公司 2018-03-13 CN disclosed
US-20170305878-A1 sGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2017-10-26 US disclosed
EP-3173407-A1 SGC STIMULATORS Ironwood Pharmaceuticals, Inc. (US) 2017-05-31 EP disclosed
EP-2588465-B1 SGC STIMULATORS IRONWOOD PHARMACEUTICALS INC (US) 2017-01-25 EP disclosed
CN-103313976-B sGC stimulators 铁木医药有限公司 2016-11-23 CN disclosed
US-20140323448-A1 sGC STIMULATORS Ironwood Pharmaceuticals Inc. (US) 2014-10-30 US disclosed
US-8748442-B2 sGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2014-06-10 US disclosed
EP-2588465-A1 SGC STIMULATORS Ironwood Pharmaceuticals, Inc. (US) 2013-05-08 EP disclosed
US-20120184516-A1 sGC Stimulators CYCLERION THERAPEUTICS, INC. 2012-07-19 US disclosed
WO-2012003405-A1 SGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-01-05 WO disclosed