SCHEMBL3978221

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
	SCHEMBL24553526	0.89	ALDH1A1 (0.50)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL31321400	0.89	ALDH1A1 (0.50)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL31243247	0.89	ALDH1A1 (0.58)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL11848196	0.89	ALDH1A1 (0.58)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL31303820	0.85	ALDH1A1 (0.55)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL2803560	0.84	GAA (0.48)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL31321396	0.83	ALDH1A1 (0.53)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL24971957	0.82	PDE5A (0.46)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL15583343	0.81	ALDH1A1 (0.42)	ABCG2ALDH1A1TP53CYP3A4HPGD
	SCHEMBL28449845	0.80	ALDH1A1 (0.45)	ABCG2ALDH1A1TP53CYP3A4HPGD

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 6 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 (1 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.