SCHEMBL4713435

COCC[C@@H](N)[C@H]1CN(c2cc(Nc3c(F)c(N4C[C@H]([C@H](N)CCOC)[C@@H](F)C4)c(OC)c4c3c(=O)n(N)c(=O)n4C3CC3)c3c(=O)[nH]c(=O)n(C4CC4)c3c2OC)C[C@@H]1F

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.

Compound	similarity	top predicted	shared targets
SCHEMBL4522289	0.81	—	—
SCHEMBL4523242	0.76	KCNH2 (0.37)	—
SCHEMBL1381707	0.76	KCNH2 (0.37)	—
SCHEMBL6527629	0.74	—	—
SCHEMBL4717107	0.74	KCNH2 (0.35)	—
SCHEMBL4516904	0.74	KCNH2 (0.35)	—
SCHEMBL5834147	0.73	KCNH2 (0.31)	—
SCHEMBL7093709	0.72	CACNA1F (0.32)	—
SCHEMBL7097311	0.72	—	—
SCHEMBL6669512	0.71	—	—

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-1255739-B1	3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS	WARNER LAMBERT CO (US)	2008-06-11	—	—	EP	claimed
US-7094780-B1	3-aminoquinazolin-2,4-dione antibacterial agents	WARNER LAMBERT COMPANY LLC (US)	2006-08-22	—	—	US	claimed
US-20060183762-A1	3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS	ZOETIS WLC LLC	2006-08-17	—	—	US	claimed
EP-1255739-B1	3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS	WARNER LAMBERT CO (US)	2008-06-11	—	—	EP	disclosed
US-7094780-B1	3-aminoquinazolin-2,4-dione antibacterial agents	WARNER LAMBERT COMPANY LLC (US)	2006-08-22	—	—	US	disclosed
US-20060183762-A1	3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS	ZOETIS WLC LLC	2006-08-17	—	—	US	disclosed