SCHEMBL7868171

SCHEMBL7868171

O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ce+3].[Ce+3].[NH2-].[NH2-].[NH2-]

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
CA5A P35218 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL6654673 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL6853592 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL27563952 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL35227 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL23608133 0.88 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL7212600 0.88 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL1173195 0.88 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL7209256 0.88 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL5907912 0.88
SCHEMBL2564287 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113398978-A Preparation method of o-chlorocyclohexanone and catalyst thereof 中石化南京化工研究院有限公司 2021-09-17 CN disclosed
CN-103626816-B The synthetic method of acetylglucosamine base imidazoles-2,4,5-triketone and bacteriostatic application HUAIHAI INSTITUTE OF TECHNOLOGY (CN) 2016-04-13 CN disclosed
US-9260611-B2 Synthesis method for self-dispersible pigment, self-dispersible pigment, ink jet ink, ink cartridge, and ink jet recording method CANON KABUSHIKI KAISHA (JP) 2016-02-16 US disclosed
CN-103626816-A Synthetic method of acetylglucosamine imidazol-2,4,5-trione and antimicrobial application HUAIHAI INST TECHNOLOGY 2014-03-12 CN disclosed
US-20120147083-A1 SYNTHESIS METHOD FOR SELF-DISPERSIBLE PIGMENT, SELF-DISPERSIBLE PIGMENT, INK JET INK, INK CARTRIDGE, AND INK JET RECORDING METHOD CANON KABUSHIKI KAISHA (JP) 2012-06-14 US disclosed
JP-2001189291-A CERIUM OXIDE POLISHING AGENT, SEMICONDUCTOR CHIP, THEIR MANUFACTURING METHOD, AND METHOD FOR POLISHING BOARD HITACHI CHEM CO LTD 2001-07-10 JP disclosed