SCHEMBL1680576

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
	SCHEMBL17346751	0.91	ALDH1A1 (0.63)	ALDH1A1HTTNPC1RAB9AEPHX1
	SCHEMBL9263805	0.89	NPC1 (0.67)	ALDH1A1HTTNPC1RAB9AEPHX1
	SCHEMBL1680843	0.86	NPC1 (0.71)	ALDH1A1HTTFFAR1NPC1RAB9A
	SCHEMBL5108159	0.85	NPC1 (0.69)	ALDH1A1HTTNPC1RAB9AEPHX1
	SCHEMBL241141	0.85	ALDH1A1 (0.58)	ALDH1A1HTTNPC1RAB9AEPHX1
	SCHEMBL23447430	0.84	NPC1 (0.57)	ALDH1A1HTTNPC1RAB9AEPHX1
	SCHEMBL3281978	0.84	FAAH (0.58)	ALDH1A1HTTNPC1RAB9AEPHX1
	SCHEMBL28397858	0.84	ALDH1A1 (0.56)	ALDH1A1HTTNPC1RAB9AEPHX1
	SCHEMBL17863575	0.82	MMP13 (0.58)	ALDH1A1HTTFFAR1NPC1RAB9A
	SCHEMBL17552096	0.82	NPC1 (0.69)	ALDH1A1HTTNPC1RAB9AEPHX1

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 12 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 (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.