SCHEMBL5487957

SCHEMBL5487957

c1c[nH]c(N=Nc2ncc[nH]2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
NPC1 O15118 1/20 0.52
HSP90AA1 P07900 1/20 0.52
AGTR1 P30556 1/20 0.52
RAB9A P51151 1/20 0.52
ALDH1A1 P00352 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NISCH Q9Y2I1 2/20 0.37
MTOR P42345 1/20 0.37
ADK P55263 1/20 0.37
ALOX15 P16050 1/20 0.34
TAAR1 Q96RJ0 2/20 0.33
ADRA1A P35348 3/20 0.31
ADRA2A P08913 2/20 0.31

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
SCHEMBL11107953 1.00 MEN1 (0.52) MEN1KMT2ANPC1HSP90AA1AGTR1
SCHEMBL11103862 1.00 MEN1 (0.52) MEN1KMT2ANPC1HSP90AA1AGTR1
Hydrochloric Acid SCHEMBL28371398 0.97 MEN1 (0.50) MEN1KMT2ANPC1HSP90AA1AGTR1
Benzene SCHEMBL28173940 0.94 MEN1 (0.48) MEN1KMT2ANPC1HSP90AA1AGTR1
Propane SCHEMBL28437167 0.87 MEN1 (0.44) MEN1KMT2ANPC1HSP90AA1AGTR1
SCHEMBL672540 0.87
SCHEMBL2448057 0.85 MEN1 (0.43) MEN1KMT2ANPC1HSP90AA1AGTR1
SCHEMBL4298276 0.85 ALDH1A1 (0.43) MEN1KMT2ANPC1HSP90AA1AGTR1
SCHEMBL14873967 0.83
SCHEMBL3069082 0.82 KMT2A (0.57) MEN1KMT2ANPC1HSP90AA1AGTR1

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
CN-116178693-B Preparation method for catalyzing copolymerization of carbon dioxide and propylene oxide by using azoimidazole modified Mn-Mg nanocluster 安徽大学 2025-02-14 CN claimed
CN-116178693-A Preparation method for catalyzing copolymerization of carbon dioxide and propylene oxide by using azoimidazole modified Mn-Mg nanocluster 安徽大学 2023-05-30 CN claimed
CN-112374542-B Submicron-grade doped tungsten oxide-based powder and preparation method and application thereof 北京航大微纳科技有限公司 2023-01-24 CN claimed
CN-100379830-C Non-reactive ink carrier formulation HEWLETT PACKARD CO (US) 2008-04-09 CN claimed
WO-2007107775-A2 PREPARATION OF OLIGONUCLEOTIDES WITH PHOTOSWITCHABLE PROPERTIES THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2007-09-27 WO claimed
EP-1499689-B1 NON-REACTIVE INK VEHICLE FORMULATION HEWLETT PACKARD DEVELOPMENT CO (US) 2006-02-22 EP claimed
CN-1643088-A non-reactive ink vehicle formulation HEWLETT PACKARD CO (US) 2005-07-20 CN claimed
EP-1499689-A1 NON-REACTIVE INK VEHICLE FORMULATION Hewlett-Packard Development Company, L.P. (US) 2005-01-26 EP claimed
EP-1499578-A2 PRIME RING SUBSTITUTED THYROID RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CARDIAC AND METABOLIC DISORDERS KARO BIO AB (SE) 2005-01-26 EP claimed
WO-2003078532-A1 NON-REACTIVE INK VEHICLE FORMULATION HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2003-09-25 WO claimed
WO-2003018515-A2 PRIME RING SUBSTITUTED THYROID RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CARDIAC AND METABOLIC DISORDERS KARO BIO AB (SE) 2003-03-06 WO claimed
US-4457859-A LIQUID CRYSTALS, ELECTROOPTICS IVASCHENKO ALEXANDR V (SU) 1984-07-03 US claimed
CN-116178693-B Preparation method for catalyzing copolymerization of carbon dioxide and propylene oxide by using azoimidazole modified Mn-Mg nanocluster 安徽大学 2025-02-14 CN disclosed
CN-116178693-B Preparation method for catalyzing copolymerization of carbon dioxide and propylene oxide by using azoimidazole modified Mn-Mg nanocluster 安徽大学 2025-02-14 CN disclosed
CN-116178693-B Preparation method for catalyzing copolymerization of carbon dioxide and propylene oxide by using azoimidazole modified Mn-Mg nanocluster 安徽大学 2025-02-14 CN disclosed
CN-114929818-B Non-porous microparticles 科思创(荷兰)有限公司 2023-11-17 CN disclosed
US-4457859-A LIQUID CRYSTALS, ELECTROOPTICS IVASCHENKO ALEXANDR V (SU) 1984-07-03 US disclosed
US-4457859-A LIQUID CRYSTALS, ELECTROOPTICS IVASCHENKO ALEXANDR V (SU) 1984-07-03 US disclosed
WO-1982000472-A1 DERIVATIVES OF 2,2-AZOIMIDAZOLE,METHOD FOR THE PREPARATION THEREOF,LIQUID CRYSTAL MATERIAL AND ELECTRO-OPTICAL DEVICE NEFEDOV V 1982-02-18 WO disclosed
US-4083843-A YELLOW DYE FOR NYLON, POLYACRYLONITRILE, WOOL AND SILK E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-04-11 US disclosed