SCHEMBL3025720

SCHEMBL3025720

NC(=O)Nc1nc(N)nc(N)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.38
APP P05067 2/20 0.36
ACHE P22303 2/20 0.36
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
CA1 P00915 2/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PEPD P12955 1/20 0.33
CA12 O43570 1/20 0.33
CYP3A4 P08684 2/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PDPK1 O15530 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 2/20 0.31
TSHR P16473 2/20 0.30
NFKB1 P19838 2/20 0.30
MAOA P21397 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL11592921 0.95 CYP1A2 (0.38) CYP1A2APPACHECA2CA9
SCHEMBL11800278 0.85 HRH4 (0.38) CYP1A2APPACHEGAAALDH1A1
Benzoguanamine SCHEMBL8849771 0.80 ADORA1 (0.61) CYP1A2APPACHEKDM4EKMT2A
SCHEMBL1677779 0.80 CYP1A2 (0.43) CYP1A2CA2CA9CA1GAA
SCHEMBL3298153 0.78 POLB (0.52) CYP1A2GAAKDM4EALDH1A1LMNA
SCHEMBL26080192 0.78 CYP1A2 (0.37) CYP1A2CA2CA9CA1CA12
SCHEMBL28908003 0.78 BCL6 (0.47) CYP1A2GAAKDM4EPEPDLMNA
SCHEMBL5052723 0.76 CYP1A2 (0.40) CYP1A2CA2CA9CA1CA12
SCHEMBL517626 0.76 ALDH1A1 (0.39) CYP1A2CA2CA9CA1GAA
SCHEMBL5150324 0.75 CYP1A2 (0.38) CYP1A2GAANPC1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117659301-A Hydrogen bond-Schiff base double self-repairing lithium single ion polymer electrolyte with self-repairing capability, and preparation method and application thereof 中山大学 2024-03-08 CN claimed
EP-0324293-B1 PROCESS FOR THE FABRICATION OF PARTICLE BOARDS WITH AMINOPLAST RESINS ELF ATOCHEM S.A. (FR) 1993-05-12 EP claimed
CN-117659301-A Hydrogen bond-Schiff base double self-repairing lithium single ion polymer electrolyte with self-repairing capability, and preparation method and application thereof 中山大学 2024-03-08 CN disclosed
CN-103801180-B A kind of air purifier ATOM BIOSCIENCE AND PHARMACEUTICAL Co.,Ltd. (CN) 2016-05-25 CN disclosed
CN-103801180-A Air purifier ATOM BIOSCIENCE AND PHARMACEUTICAL CO LTD 2014-05-21 CN disclosed
CN-101669967-B Silver-containing wound care device, composition thereof, and method of producing same MILLIKEN & CO 2013-06-05 CN disclosed
CN-102269945-B Electrophotographic photosensitive member, process cartridge and electrophotographic apparatus, and process for producing electrophotographic photosensitive member CANON KK 2013-03-27 CN disclosed
CN-102743785-A Silver-containing wound care device, composition therefor, and method of producing MILLIKEN & CO 2012-10-24 CN disclosed
US-8261803-B2 Plate press HUECK RHEINISCHE GMBH (DE) 2012-09-11 US disclosed
CN-102269945-A Electrophotographic photosensitive member, process cartridge and electrophotographic apparatus, and process for producing electrophotographic photosensitive member 2011-12-07 CN disclosed
US-20100200172-A1 Plate press HUECK RHEINISCHE GMBH (DE) 2010-08-12 US disclosed
CN-101247857-A Oral care compositions having improved substantivity MCNEIL PPC INC (US) 2008-08-20 CN disclosed
CN-1287803-C Promoting whole body health PROCTER & GAMBLE (US) 2006-12-06 CN disclosed
CN-1835840-A Silver-containing wound care devices, compositions thereof, and methods of making same MILLIKEN & CO (US) 2006-09-20 CN disclosed
CN-1575974-A Biaxially oriented multi-layer polypropylene film and the use thereof TOHCELLO CO LTD (JP) 2005-02-09 CN disclosed
CN-1536989-A Oral compositions comprising host-respones modulating agent for promoting whole body health 2004-10-13 CN disclosed
CN-1522149-A Promoting whole body health 2004-08-18 CN disclosed
CN-1440268-A Promoting whole body health PROCTER & GAMBLE (US) 2003-09-03 CN disclosed
EP-0324293-A1 Process for the fabrication of particle boards with aminoplast resins ELF ATOCHEM S.A. (FR) 1989-07-19 EP disclosed
US-3940365-A PHENOLIC ANTIOXIDANT AND AN UREA OR AN OXALIC ACID DIAMIDE OR AN AZODICARBOXYLIC AMIDE HOECHST AKTIENGESELLSCHAFT (DT) 1976-02-24 US disclosed