SCHEMBL682780

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
	SCHEMBL874718	1.00	ABCB1 (0.46)	ABCB1NR1H2NR1H3PDE4BHRH1
	SCHEMBL2141244	0.96	ABCB1 (0.46)	ABCB1NR1H2NR1H3PDE4BCHRM5
	SCHEMBL683071	0.96	ABCB1 (0.46)	ABCB1NR1H2NR1H3PDE4BCHRM5
	SCHEMBL2088855	0.93	PDE4B (0.50)	ABCB1NR1H2NR1H3PDE4B
	SCHEMBL682919	0.93	PDE4B (0.50)	ABCB1NR1H2NR1H3PDE4B
	SCHEMBL682652	0.87	NR1H2 (0.47)	ABCB1NR1H2NR1H3PDE4BCHRM4
	SCHEMBL876732	0.87	NR1H2 (0.47)	ABCB1NR1H2NR1H3PDE4BCHRM4
	SCHEMBL873257	0.86	PDE4B (0.51)	NR1H2NR1H3PDE4B
	SCHEMBL2140386	0.85	PDE4B (0.48)	NR1H2NR1H3PDE4B
	SCHEMBL2141419	0.85	PDE4B (0.50)	NR1H2NR1H3PDE4B

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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.