SCHEMBL1843705

SCHEMBL1843705

CCNC(=O)Nc1nc2c(F)c(-c3cncc(C(=O)O)c3)cc(-c3ncccc3F)c2s1.[LiH]

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
Lithium SCHEMBL1843711 0.98 — —
Lithium Ion SCHEMBL1843706 0.91 PIK3CD (0.38) —
SCHEMBL2181540 0.91 PIK3CA (0.40) —
SCHEMBL1848020 0.90 PIK3CD (0.40) —
SCHEMBL1843004 0.89 MAPK1 (0.43) —
SCHEMBL1843498 0.89 ABL1 (0.42) —
SCHEMBL1840274 0.89 — —
SCHEMBL1842147 0.88 — —
SCHEMBL1842521 0.88 MAPK1 (0.40) —
SCHEMBL1843794 0.87 ABL1 (0.47) —

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
US-20110166088-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2011-07-07 — — US claimed
US-20110166088-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2011-07-07 — — US disclosed
EP-2321309-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS Ranbaxy Laboratories Limited (IN) 2011-05-18 — — EP disclosed
WO-2009156966-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-12-30 — — WO disclosed
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