SCHEMBL2769491

SCHEMBL2769491

N#CCOS(=O)(=O)[O-].N#CCOS(=O)(=O)[O-].[Cu+2]

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.32
GLA P06280 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
EPHX2 P34913 1/20 0.32
BLM P54132 1/20 0.32

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
SCHEMBL2937219 1.00 RECQL (0.32) RECQLGLAHPGDTSHRMAPK1
Tetrabuthylammonium SCHEMBL7880331 0.77 RECQL (0.46) RECQLGLAHPGDTSHRMAPK1
Tetrabuthylammonium SCHEMBL3255325 0.75 RECQL (0.44) RECQLGLAHPGDTSHRMAPK1
Lithium Ion SCHEMBL17456575 0.72 RECQL (0.34) RECQLGLAHPGDTSHRMAPK1
Lithium Ion SCHEMBL17456510 0.70 RECQL (0.39) RECQLGLAHPGDTSHRMAPK1
SCHEMBL17456476 0.68 CA2 (0.35) RECQLGLAHPGDTSHRMAPK1
Lithium Ion SCHEMBL17456420 0.68
SCHEMBL17456413 0.68
Ammonia Solution, Strong SCHEMBL5462398 0.68
Lithium Ion SCHEMBL22189212 0.65 ADAM17 (0.36) RECQLGLAHPGDTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149071-A1 D-AMINOACYLASE ISOBE KIMIYASU (JP) 2012-06-14 US disclosed
EP-1057894-B1 Esterase genes and uses of the same SUMITOMO CHEMICAL CO (JP) 2010-04-28 EP disclosed
US-20090215118-A1 D-AMINOACYLASE DAIICHI PURE CHEMICALS CO., LTD. (JP) 2009-08-27 US disclosed
US-20080096244-A1 D-AMINOACYLASE DAIICHI PURE CHEMICALS CO., LTD. (JP) 2008-04-24 US disclosed
US-20060172375-A1 D-aminoacylase DAIICHI PURE CHEMICALS CO., LTD (JP) 2006-08-03 US disclosed
US-6828129-B2 Nucleotide sequences coding polypeptide for use as tool in genetic engineering SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2004-12-07 US disclosed
US-6812008-B2 NUCLEOTIDE SEQUENCES CODING POLYPEPTIDE FOR USE IN THE GENERATION OF S-N-BENZYLAZETIDINE-2-CARBOXYLIC ACID SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-02 US disclosed
US-6537790-B1 Isolated protein of given sequence which can produce N-substituted cyclic imino acids by hydrolization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-25 US disclosed
US-20020173013-A1 Esterace genes and uses of the same SUMITOMO CHEMICAL COMPANY, LIMITED 2002-11-21 US disclosed
US-20020164727-A1 Nucleotide sequences coding polypeptide for use as tool in genetic engineering SUMITOMO CHEMICAL COMPANY, LIMITED 2002-11-07 US disclosed
EP-1057894-A2 Esterase genes and uses of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-12-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020164727-A1 Nucleotide sequences coding polypeptide for use as tool in genetic engineering IMPDH2, INHA, IMPDH1 RECQL 1371/4885GLA 973/4885HPGD 171/4885
US-20020173013-A1 Esterace genes and uses of the same ACOT7, COASY, IMPA1 RECQL 2448/4885GLA 523/4885HPGD 977/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.