SCHEMBL9889922

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
	SCHEMBL12306558	0.91	HSD17B1 (0.45)	HSD17B1HSD17B2PDK2NQO2MEN1
	SCHEMBL12306512	0.89	HSD17B1 (0.46)	HSD17B1HSD17B2PDK2NQO2MEN1
	SCHEMBL9889920	0.88	PDK2 (0.42)	HSD17B1HSD17B2PDK2NQO2MEN1
	SCHEMBL9889935	0.87	PDK2 (0.41)	HSD17B1HSD17B2PDK2PGRRARA
	SCHEMBL12306546	0.85	PDK2 (0.46)	HSD17B1HSD17B2PDK2NQO2
	SCHEMBL9889924	0.83	PDK2 (0.33)	HSD17B1HSD17B2PDK2PGR
	SCHEMBL12306545	0.82	HSD17B1 (0.40)	HSD17B1HSD17B2PDK2NQO2CYP3A4
	SCHEMBL22849302	0.81	PDK2 (0.41)	PDK2
	SCHEMBL13020737	0.81	APP (0.43)	HSD17B1HSD17B2PDK2NQO2MEN1
	SCHEMBL13125841	0.80	APP (0.45)	HSD17B1HSD17B2PDK2NQO2MEN1

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 32 patents — showing the first 20. 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 (8 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.