SCHEMBL22254834

SCHEMBL22254834

CC(Cc1ccc(-n2ccc(NC(=O)N3CCNCC3)nc2=O)cc1)N(C)C[C@H]1C[C@@H](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
SCHEMBL22254823 1.00 — —
SCHEMBL25531951 1.00 — —
SCHEMBL22254464 0.93 — —
SCHEMBL25531828 0.93 — —
SCHEMBL22254847 0.91 POLB (0.30) —
SCHEMBL22254824 0.91 — —
SCHEMBL25531953 0.91 — —
SCHEMBL22254061 0.89 TRPV1 (0.30) —
SCHEMBL22253964 0.89 TRPV1 (0.30) —
SCHEMBL22253963 0.89 TRPV1 (0.30) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 — — US disclosed
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 — — US disclosed
WO-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 — — WO disclosed
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