SCHEMBL3391924

SCHEMBL3391924

Nc1nc(C(=NOC(c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)N[C@H]2C(=O)N3C(C(=O)OC(c4ccccc4)c4ccccc4)=C(Sc4nncs4)CCC23)c(Cl)s1

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
SCHEMBL14184725 1.00 — —
SCHEMBL14174245 1.00 — —
SCHEMBL14174242 0.93 — —
SCHEMBL3391897 0.93 — —
SCHEMBL6542128 0.90 KCNH2 (0.39) —
SCHEMBL6542123 0.90 KCNH2 (0.39) —
SCHEMBL3092086 0.88 KCNH2 (0.39) —
SCHEMBL3092076 0.88 KCNH2 (0.39) —
SCHEMBL3076694 0.88 KCNH2 (0.39) —
SCHEMBL3092083 0.88 KCNH2 (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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2161268-A1 Carbacephem beta-lactam compounds for the treatment of bacterial infections Trine Pharmaceuticals, Inc. (US) 2010-03-10 — — EP disclosed
EP-1618106-B1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS TRINE PHARMACEUTICALS INC (US) 2009-11-25 — — EP disclosed
US-20080146535-A1 Compositions comprising carbacephem beta-lactam antibiotics and beta-lactamase inhibitors BLANCA PHARMACEUTICALS, INC. 2008-06-19 — — US disclosed
EP-1618106-A4 CARBACEPHEM -LACTAM ANTIBIOTICS TRINE PHARMACEUTICALS INC (US) 2006-11-22 — — EP disclosed
US-7109190-B2 Carbacephem β-lactam antibiotics TRINE PHARMACEUTICALS, INC. (US) 2006-09-19 — — US disclosed
EP-1618106-A2 CARBACEPHEM -LACTAM ANTIBIOTICS Trine Pharmaceuticals, Inc. (US) 2006-01-25 — — EP disclosed
US-20050004095-A1 Carbacephem beta-lactam antibiotics TRINE PHARMACEUTICALS, INC. 2005-01-06 — — US disclosed
WO-2004098500-A2 CARBACEPHEM ss-LACTAM ANTIBIOTICS TRINE PHARMACEUTICALS, INC. (US) 2004-11-18 — — WO disclosed
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