SCHEMBL3058544

SCHEMBL3058544

CC(C)NNC(N)=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
SCHEMBL12703405 0.78 MAOA (0.36)
SCHEMBL3416543 0.76 SLC7A5 (0.40)
SCHEMBL3416544 0.76 SLC7A5 (0.40)
SCHEMBL10408938 0.76 SLC7A5 (0.40)
SCHEMBL21776623 0.74
SCHEMBL21785 0.73
SCHEMBL15795937 0.73
SCHEMBL1485441 0.73
SCHEMBL10869084 0.72 CYP1A2 (0.39)
SCHEMBL11508159 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2988597-B1 MACROLIDES AND METHODS OF THEIR PREPARATION AND USE HARVARD COLLEGE (US) 2022-06-08 EP disclosed
US-11247994-B2 6-dithio-substituted-2′-deoxyguanosine compound, preparation method thereof and use thereof ZHEJIANG UNIVERSITY (CN) 2022-02-15 US disclosed
WO-2021242923-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF AXIAL THERAPEUTICS, INC. (US) 2021-12-02 WO disclosed
US-20210130356-A1 6-DITHIO-SUBSTITUTED-2'-DEOXYGUANOSINE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF ZHEJIANG UNIVERSITY (CN) 2021-05-06 US disclosed
CN-109053841-B 6-disulfur substituted-2' -deoxyguanosine compound and preparation method and application thereof 浙江大学 2020-11-17 CN disclosed
US-10379105-B2 Antibodies to aripiprazole haptens and use thereof JANSSEN PHARMACEUTICA NV (BE) 2019-08-13 US disclosed
US-10246478-B2 Polyene macrolide derivative SHIONOGI & CO., LTD. (JP) 2019-04-02 US disclosed
CN-109053841-A The bis- sulphur of 6- replace -2 '-deoxyguanosine class compounds and its preparation method and application 浙江大学 2018-12-21 CN disclosed
US-20170204198-A1 Antibodies to Aripiprazole Haptens and Use Thereof JANSSEN PHARMACEUTICA NV (BE) 2017-07-20 US disclosed
US-20170190729-A1 POLYENE MACROLIDE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2017-07-06 US disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
US-5904857-A REMOVAL OF DISSOLVED OXYGEN FROM ALKALINE WATER NALCO CHEMICAL COMPANY (US) 1999-05-18 US disclosed
CN-1200357-A 4-alkyl semicarbazides as oxygen scavengers NALCO CHEMICAL CO (US) 1998-12-02 CN disclosed
EP-0875604-A1 Substituted semicarbazides as oxygen scavengers NALCO CHEMICAL COMPANY (US) 1998-11-04 EP disclosed