SCHEMBL13580437

CCC(C)(C)C1=CC(=C/N=N/c2ccc(-c3ccc(/N=N/C=C4C=C(C(C)(C)CC)C(=O)C(C(C)(C)CC)=C4)c(Cl)c3)cc2Cl)C=C(C(C)(C)CC)C1=O

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
SCHEMBL13580321	0.88	NPC1 (0.36)	—
SCHEMBL13580377	0.82	NPC1 (0.33)	—
SCHEMBL13580390	0.82	KMT2A (0.35)	—
SCHEMBL13580387	0.81	NPC1 (0.32)	—
SCHEMBL13580380	0.79	NPC1 (0.32)	—
SCHEMBL13580405	0.79	SMN1; SMN2 (0.32)	—
SCHEMBL13580386	0.78	NPC1 (0.32)	—
SCHEMBL18877730	0.78	KMT2A (0.36)	—
SCHEMBL13580735	0.77	NPC1 (0.31)	—
SCHEMBL13580391	0.74	AKR1C3 (0.33)	—

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
US-20090317733-A1	Quinone Compound, Electrophotographic Photoconductor and Electrophotographic Apparatus	FUJI ELECTRIC DEVICE TECHNOLOGY CO., LTD. (JP)	2009-12-24	—	—	US	disclosed
US-20090317733-A1	Quinone Compound, Electrophotographic Photoconductor and Electrophotographic Apparatus	FUJI ELECTRIC DEVICE TECHNOLOGY CO., LTD. (JP)	2009-12-24	—	—	US	disclosed