SCHEMBL2092045

SCHEMBL2092045

C=CCNC1CC[N]C1

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
SCHEMBL9836904 0.87 KMT2A (0.33)
SCHEMBL530785 0.74
SCHEMBL7735833 0.74 KMT2A (0.39)
SCHEMBL689663 0.71
SCHEMBL666631 0.71
SCHEMBL666686 0.71
SCHEMBL538845 0.70
SCHEMBL818299 0.70
SCHEMBL2093735 0.70
SCHEMBL6949868 0.69 SIGMAR1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030232818-A1 Antibacterial compounds ABBVIE INC. 2003-12-18 US claimed
US-8163769-B2 1,8-naphthyridine derivatives ABBOTT LABORATORIES (US) 2012-04-24 US disclosed
US-20030232818-A1 Antibacterial compounds ABBVIE INC. 2003-12-18 US disclosed
EP-0101829-B1 TRICYCLIC COMPOUNDS, A PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID COMPOUNDS DAIICHI SEIYAKU CO., LTD. (JP) 1986-12-30 EP disclosed
US-4539401-A Pyridobenzoxazine derivatives useful as antibacterial agents DAIICHI SEIYAKU CO., LTD. (JP) 1985-09-03 US disclosed
US-4535161-A ANTIBIOTIC, BACTERICIDE DAIICHI SEIYAKU CO., LTD. (JP) 1985-08-13 US disclosed
EP-0101829-A2 Tricyclic compounds, a process for their production and pharmaceutical compositions containing said compounds DAIICHI SEIYAKU CO., LTD. (JP) 1984-03-07 EP disclosed