SCHEMBL1594800

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
	SCHEMBL2633819	0.84	GAA (0.67)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL3010846	0.84	GAA (0.64)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL1593778	0.84	PTGES2 (0.67)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL3471069	0.81	TP53 (0.54)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL15480638	0.79	GAA (0.56)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL1594386	0.79	RAB9A (0.73)	GAAL3MBTL1ALDH1A1MAPTNPC1
	SCHEMBL1594279	0.78	GAA (0.65)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL5232747	0.78	GAA (0.47)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL3461026	0.78	ITGB1 (0.64)	GAAL3MBTL1ALDH1A1PTGES2POLB
	SCHEMBL3474698	0.78	NPC1 (0.58)	GAAL3MBTL1ALDH1A1PTGES2POLB

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 21 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 (3 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.