SCHEMBL814595

SCHEMBL814595

O=CNc1ncc[nH]1

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
Hydrochloric Acid SCHEMBL28733425 0.98 FDPS (0.43)
SCHEMBL8670940 0.81 ADRA2A (0.44)
SCHEMBL7406981 0.77
SCHEMBL2849057 0.77
SCHEMBL708660 0.75 ADRA2A (0.56)
SCHEMBL7340791 0.73
SCHEMBL2787049 0.72 ALDH1A1 (0.32)
SCHEMBL8310366 0.72 ADRA2A (0.48)
SCHEMBL7342763 0.71 FFAR2 (0.46)
SCHEMBL2981194 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110520127-A Piperidinyl-substituted and piperazinyl-substituted heteroaromatic carboxamides as modulators of GPR6 TAKEDA PHARMACEUTICALS CO 2019-11-29 CN claimed
CN-109939113-A Bicyclic bromine structural domain inhibitor 齐尼思表观遗传学有限公司 2019-06-28 CN claimed
CN-105407888-B Novel bicyclic bromodomain inhibitors 齐尼思表观遗传学有限公司 2019-05-21 CN claimed
CN-109476637-A heterocyclic Prolinamide derivatives 奥瑞恩眼科有限责任公司 2019-03-15 CN claimed
CN-105431418-B Metalloenzyme Inhibitor Compounds 北卡罗来纳维亚梅特制药公司 2019-02-05 CN claimed
CN-106029639-B Treat 2- amino -3,5 of the BACE1 inhibitor of Alzheimer disease, 5- tri- fluoro- 3,4,5,6- tetrahydropyridines H.隆德贝克有限公司 2019-01-08 CN claimed
CN-105283443-B Hete rocyclic derivatives and application thereof 株式会社C&C新药研究所 2018-08-17 CN claimed
CN-108368089-A Novel Compounds 特殊治疗有限公司 2018-08-03 CN claimed
CN-108314680-A One kind containing aromatic compound, preparation method, pharmaceutical composition and application 凯惠科技发展(上海)有限公司 2018-07-24 CN claimed
CN-105518005-B Tricyclic pyridine-carboxamide derivatives as ROCK inhibitors 百时美施贵宝公司 2018-07-20 CN claimed
EP-0626983-B1 POLYMERIC BLENDS WITH ZWITTERIONIC GROUPS BIOCOMPATIBLES LTD (GB) 1999-04-14 EP claimed
EP-0714417-B1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LTD (GB) 1998-06-10 EP claimed
US-5712326-A TO IMPROVE BIOCOMPATIBILITY; REDUCE FIBRINOGEN ABSORPTION AND/OR PLATELET ACTIVATION BIOCOMPATIBLES LIMITED (GB) 1998-01-27 US claimed
US-5645883-A Zwitterionic materials BIOCOMPATIBLES LIMITED (GB) 1997-07-08 US claimed
EP-0714417-A1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LIMITED (GB) 1996-06-05 EP claimed
EP-0681486-A1 NEW ZWITTERIONIC MATERIALS BIOCOMPATIBLES LIMITED (GB) 1995-11-15 EP claimed
WO-1995005408-A1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LIMITED (GB) 1995-02-23 WO claimed
EP-0626983-A1 POLYMERIC BLENDS WITH ZWITTERIONIC GROUPS BIOCOMPATIBLES LIMITED (GB) 1994-12-07 EP claimed
WO-1994016749-A1 NEW ZWITTERIONIC MATERIALS BIOCOMPATIBLES LIMITED (GB) 1994-08-04 WO claimed
WO-1994014897-A1 POLYMERIC BLENDS WITH ZWITTERIONIC GROUPS BIOCOMPATIBLES LIMITED (GB) 1994-07-07 WO claimed