SCHEMBL6745083

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
	SCHEMBL16555191	0.86	ALDH1A1 (0.36)	ALDH1A1CA1CA2MAOAMAOB
	SCHEMBL578005	0.84	CA1 (0.46)	ALDH1A1CA1CA2CA7CA9
	Hydrogen Peroxide SCHEMBL29099624	0.83	ALDH1A1 (0.46)	ALDH1A1CA1CA2CA7CA9
	SCHEMBL15371492	0.82	ALDH1A1 (0.50)	ALDH1A1CA1CA2CA7CA9
	SCHEMBL29558423	0.78	CA2 (0.38)	ALDH1A1CA1CA2CA7CA9
	SCHEMBL3712483	0.78	ALDH1A1 (0.31)	ALDH1A1
	SCHEMBL12164462	0.77	ALDH1A1 (0.50)	ALDH1A1CA1CA2CA7CA9
	SCHEMBL6745071	0.77	CES2 (0.41)	ALDH1A1MAOBACHE
	SCHEMBL2420963	0.77	CYP1A2 (0.35)	ALDH1A1CYP1A2CYP2A6TSHRLMNA
	SCHEMBL29558466	0.76	TRPA1 (0.50)	ALDH1A1CA1CA2CA7CA9

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 15 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.