SCHEMBL5998249

SCHEMBL5998249

CCNNN=CN1CCNCC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8197878 0.79 MAPT (0.30)
SCHEMBL8205876 0.79
SCHEMBL8205113 0.78 HSD17B10 (0.30)
SCHEMBL8205184 0.73 SIGMAR1 (0.44)
SCHEMBL8206526 0.71 TACR1 (0.43)
SCHEMBL5092581 0.70
SCHEMBL17383925 0.68
Hydrochloric Acid SCHEMBL9399766 0.66 LMNA (0.31)
SCHEMBL19546015 0.66 HIF1A (0.32)
SCHEMBL9785050 0.66 GNAI3 (0.33)

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 8 patents. 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 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
EP-0973780-B1 ANTIBACTERIAL SUBSTITUTED 7-ACYLAMINO -3-(METHYLHYDRAZONO) METHYL-CEPHALOSPORINS AND INTERMEDIATES BIOCHEMIE GMBH (AT) 2003-07-02 EP 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