SCHEMBL8917599

CCCCCCCCc1ncc(-c2ccc([C@H](O[C@@H](c3ccc(-c4cnc(CCCCCCCC)nc4)cc3)C3COC4(CCCCC4)O3)C3COC4(CCCCC4)O3)cc2)cn1

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
SCHEMBL8917609	1.00	—	—
SCHEMBL8917931	0.89	ADRA1D (0.31)	—
SCHEMBL8917939	0.89	ADRA1D (0.31)	—
SCHEMBL9523947	0.88	—	—
SCHEMBL8916677	0.86	KDM4E (0.31)	—
SCHEMBL8916664	0.86	KDM4E (0.31)	—
SCHEMBL9524945	0.79	HTR1A (0.40)	—
SCHEMBL9524949	0.79	HTR1A (0.40)	—
SCHEMBL9524937	0.77	MEN1 (0.45)	—
SCHEMBL9525010	0.77	SLC5A2 (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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-5651918-A	Optically active 1,3-dioxolane derivatives carrying a mesogenic radical in the 4-position, a process for their preparation and their use as doping agents in liquid-crystal mixtures	HOECHST AKTIENGESELLSCHAFT (DE)	1997-07-29	—	—	US	disclosed
EP-0351746-B1	Optically active 1,3-dioxolane derivatives containing a mesogene group in position 4, method for their preparation and their use as doping agents in liquid-crystal mixtures	HOECHST AG (DE)	1993-12-29	—	—	EP	disclosed
EP-0351746-A1	Optically active 1,3-dioxolane derivatives containing a mesogene group in position 4, method for their preparation and their use as doping agents in liquid-crystal mixtures	HOECHST AKTIENGESELLSCHAFT (DE)	1990-01-24	—	—	EP	disclosed