SCHEMBL6987646

CC1(C)CC(CCCCNc2nc(NCCCCC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)nc(C(NCCCN)(c3nc(NCCCCC4CC(C)(C)N(OC5CCCCC5)C(C)(C)C4)nc(NCCCCC4CC(C)(C)N(OC5CCCCC5)C(C)(C)C4)n3)C(NCCCN)(c3nc(NCCCCC4CC(C)(C)N(OC5CCCCC5)C(C)(C)C4)nc(NCCCCC4CC(C)(C)N(OC5CCCCC5)C(C)(C)C4)n3)c3nc(NCCCCC4CC(C)(C)N(OC5CCCCC5)C(C)(C)C4)nc(NCCCCC4CC(C)(C)N(OC5CCCCC5)C(C)(C)C4)n3)n2)CC(C)(C)N1OC1CCCCC1

nearest known ligand 0.30

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	NPC1	O15118	1/20	0.30

▸	MITF	O75030	1/20	0.30

▸	RAB9A	P51151	1/20	0.30

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
SCHEMBL28697671	0.87	NPC1 (0.32)	NPC1MITFRAB9A
SCHEMBL1231055	0.86	TNKS2 (0.34)	—
SCHEMBL7058617	0.83	—	—
SCHEMBL9428266	0.83	TLR7 (0.36)	—
SCHEMBL9428473	0.83	TLR7 (0.35)	NPC1MITFRAB9A
SCHEMBL526852	0.81	KMT2A (0.36)	—
SCHEMBL452494	0.81	KMT2A (0.36)	—
SCHEMBL9428455	0.81	KMT2A (0.38)	—
SCHEMBL9428448	0.81	KMT2A (0.38)	—
SCHEMBL9429087	0.81	KMT2A (0.38)	—

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-1337520-A1	SUBSTITUTED 5-ARYL AND 5-HETEROARYL-2-(2-HYDROXYPHENYL)-2H-BENZOTRIAZOLE DERIVATIVES AS UV ABSORBERS	Ciba SC Holding AG (CH)	2003-08-27	—	—	EP	disclosed
WO-2002042281-A1	SUBSTITUTED 5-ARYL AND 5-HETEROARYL-2-(2-HYDROXYPHENYL)-2H-BENZOTRIAZOLE DERIVATIVES AS UV ABSORBERS	CIBA SPECIALTY CHEMICALS HOLDING INC. (CH)	2002-05-30	—	—	WO	disclosed