SCHEMBL7206153

SCHEMBL7206153

O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[La+3].[Y+3]

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
SCHEMBL7206154 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL8965657 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL82597 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL5828494 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL2905909 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL27527123 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL133022 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL25187157 0.88 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Hydrochloric Acid SCHEMBL11036652 0.88
Water SCHEMBL72442 0.88 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0893428-B1 A process for preparing dialkyl carbonates NIPPON CATALYTIC CHEM IND (JP) 2003-01-22 EP disclosed
EP-0893428-A1 A process for preparing dialkyl carbonates NIPPON SHOKUBAI CO., LTD. (JP) 1999-01-27 EP disclosed
US-5430170-A Esterification of alkalene carbonate with an alcohol in presence of rare earth catalyst NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-04 US disclosed
EP-0599287-A1 A process for preparing dialkyl carbonates NIPPON SHOKUBAI CO., LTD. (JP) 1994-06-01 EP disclosed