SCHEMBL1593440

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
	SCHEMBL1593804	0.87	ALDH1A1 (0.62)	ALDH1A1PDK2ERN1GAAL3MBTL1
	SCHEMBL1593436	0.84	PDK2 (0.47)	ALDH1A1PDK2KEAP1NFE2L2ERN1
	SCHEMBL1593692	0.84	PDK2 (0.47)	ALDH1A1PDK2KEAP1NFE2L2ERN1
	SCHEMBL14412421	0.82	PDK2 (0.50)	ALDH1A1PDK2FYNGAAL3MBTL1
	SCHEMBL1593532	0.81	ALDH1A1 (0.58)	ALDH1A1KEAP1NFE2L2GAAL3MBTL1
	SCHEMBL1594138	0.79	RAB9A (0.57)	ALDH1A1PDK2KEAP1NFE2L2ERN1
	SCHEMBL1594715	0.78	HPGD (0.60)	ALDH1A1ERN1SMN1; SMN2NPC1
	SCHEMBL13098073	0.76	TP53 (0.59)	ALDH1A1L3MBTL1SMN1; SMN2NPC1
	SCHEMBL1595260	0.74	ALDH1A1 (1.00)	ALDH1A1GAAL3MBTL1SMN1; SMN2NPC1
	SCHEMBL5306702	0.74	ALDH1A1 (0.49)	ALDH1A1GAAL3MBTL1SMN1; SMN2NPC1

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.