SCHEMBL5995283

SCHEMBL5995283

CN(N)C(=N)N1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
CHKA P35790 1/20 0.34
CHRNB2 P17787 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
CHRNB3 Q05901 1/20 0.33
CHRNA6 Q15825 1/20 0.33
PHGDH O43175 1/20 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
SCHEMBL8206217 0.89
SCHEMBL8520660 0.82 CA2 (0.38) CA2CA12CA1CA9CHKA
SCHEMBL5995298 0.82 CA2 (0.32) CA2CA12CA1CA9CHKA
SCHEMBL13206291 0.79 F2 (0.44)
SCHEMBL13206292 0.77 F2 (0.48) CA2CA12CA1CA9PHGDH
SCHEMBL13206287 0.76 CYP1A2 (0.39) PHGDH
SCHEMBL25703358 0.74 CA2 (0.45) CA2CA12CA1CA9CHKA
SCHEMBL13206289 0.74 LMNA (0.45) CA2CA12CA1CA9PHGDH
SCHEMBL3628581 0.74 PHGDH (0.38) CA2CA12CA1CA9CHKA
SCHEMBL5993927 0.74

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
US-20060223789-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates NABRIVA THERAPEUTICS AG (AT) 2006-10-05 US claimed
US-20040132709-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates ASCHER GERD (AT) 2004-07-08 US claimed
US-20030114665-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates ASCHER GERD (AT) 2003-06-19 US claimed
US-20020115852-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates ASCHER GERD (AT) 2002-08-22 US claimed
US-20020091252-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates NABRIVA THERAPEUTICS AG (AT) 2002-07-11 US claimed
CN-1251591-A Substituted 7-acylamino-3- (methylhydrazono) methylcephalosporin with antibacterial action and intermediate BIOCHEMIE CO LTD (AT) 2000-04-26 CN claimed
US-7317101-B2 Antibacterial cephalosporins SANDOZ GMBH (AT) 2008-01-08 US disclosed
US-7317101-B2 Antibacterial cephalosporins SANDOZ GMBH (AT) 2008-01-08 US disclosed
US-20060223789-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates NABRIVA THERAPEUTICS AG (AT) 2006-10-05 US disclosed
CN-1515574-A Substituted 7-acylamino-3-(methyldiazanediyl) methylcephalosporin and intermediate body with antibiotic action 生物化学有限公司 2004-07-28 CN disclosed
US-20040132709-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates ASCHER GERD (AT) 2004-07-08 US disclosed
US-6693095-B2 7-(((5-AMINO-1,2,4-THIADIAZOL-3-YL)-(Z)-(FLUORMETHOXYIMINO) -ACETYL)AMINO)-3(E)-((IMINO-1-PIPERAZINYLMETHYL)-METHYLHYDRAZONO)METHYL-3 -CEPHEM-4-CARBOXYLIC ACID TRIHYDROCHLORIDE FOR EXAMPLE BIOCHEMIE GESELLSCHAFT M.B.H. (AT) 2004-02-17 US disclosed
CN-1117095-C Substituted 7-acylamino-3- (methylhydrazono) methylcephalosporin with antibacterial action and intermediate BIOCHEMIE CO LTD (AT) 2003-08-06 CN disclosed
US-20030114665-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates ASCHER GERD (AT) 2003-06-19 US disclosed
EP-1300408-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono)methyl-cephalosporins and intermediates BIOCHEMIE Gesellschaft m.b.H. (AT) 2003-04-09 EP disclosed
US-20020115852-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates ASCHER GERD (AT) 2002-08-22 US disclosed
US-20020091252-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates NABRIVA THERAPEUTICS AG (AT) 2002-07-11 US disclosed
CN-1251591-A Substituted 7-acylamino-3- (methylhydrazono) methylcephalosporin with antibacterial action and intermediate BIOCHEMIE CO LTD (AT) 2000-04-26 CN disclosed
EP-0973780-A1 ANTIBACTERIAL SUBSTITUTED 7-ACYLAMINO -3-(METHYLHYDRAZONO) METHYL-CEPHALOSPORINS AND INTERMEDIATES BIOCHEMIE GESELLSCHAFT M.B.H. (AT) 2000-01-26 EP disclosed
WO-1998043981-A1 ANTIBACTERIAL SUBSTITUTED 7-ACYLAMINO-3-(METHYLHYDRAZONO)METHYL -CEPHALOSPORINS AND INTERMEDIATES BIOCHEMIE GESELLSCHAFT MBH (AT) 1998-10-08 WO 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 (5 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-20030114665-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates MRPL21, Q6ZSR9, EMG1 CA2 4134/4885CA12 4665/4885CA1 4759/4885
US-20020115852-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates MRPL21, Q6ZSR9, EMG1 CA2 4134/4885CA12 4665/4885CA1 4759/4885
US-20020091252-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates MRPL21, Q6ZSR9, EMG1 CA2 4134/4885CA12 4665/4885CA1 4759/4885
US-20060223789-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates MRPL21, Q6ZSR9, PRMT7 CA2 4341/4885CA12 4718/4885CA1 4858/4885
US-20040132709-A1 Antibacterial substituted 7-acylamino-3-(methylhydrazono) methyl-cephalosporins and intermediates MRPL21, Q6ZSR9, EMG1 CA2 4134/4885CA12 4665/4885CA1 4759/4885

“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.