SCHEMBL6673449

NC1([C@@H]2CCN(c3c(F)cc4c(=O)[nH]c(=O)n(C5CC5)c4c3OC(F)F)C2)CC1.O=c1[nH]c(=O)n(C2CC2)c2c(OC(F)F)c(F)c(F)cc12

nearest known ligand 0.46

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	KCNH2	Q12809	11/20	0.46

▸	SCN5A	Q14524	2/20	0.45

▸	CYP1A2	P05177	1/20	0.33

▸	CYP3A4	P08684	1/20	0.33

▸	CYP2D6	P10635	1/20	0.33

▸	CYP2C9	P11712	1/20	0.33

▸	CYP2C19	P33261	1/20	0.33

▸	CACNA1C	Q13936	1/20	0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL6671318	0.97	KCNH2 (0.48)	KCNH2SCN5ACYP1A2CYP3A4CYP2D6
SCHEMBL6671306	0.97	KCNH2 (0.48)	KCNH2SCN5ACYP1A2CYP3A4CYP2D6
SCHEMBL6671328	0.82	EEF2K (0.35)	CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL6674178	0.81	KCNH2 (0.64)	KCNH2SCN5A
Hydrochloric Acid SCHEMBL7094190	0.81	KCNH2 (0.64)	KCNH2SCN5A
Hydrochloric Acid SCHEMBL6671352	0.80	KCNH2 (0.50)	KCNH2SCN5ACYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL6669502	0.80	KCNH2 (0.50)	KCNH2SCN5ACYP1A2CYP3A4CYP2D6
SCHEMBL6377126	0.75	KCNH2 (0.34)	KCNH2SCN5ACYP1A2CYP3A4CYP2D6
SCHEMBL6672152	0.72	KCNH2 (0.45)	KCNH2SCN5ACYP3A4
SCHEMBL6670555	0.72	KCNH2 (0.47)	KCNH2SCN5A

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-1401830-A2	QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS	Warner-Lambert Company LLC (US)	2004-03-31	—	—	EP	disclosed
WO-2002102793-A2	QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS	WARNER-LAMBERT COMPANY LLC (US)	2002-12-27	—	—	WO	disclosed