SCHEMBL4019893

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
	SCHEMBL11938125	1.00	ALDH1A1 (0.50)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL5509505	0.86	ALDH1A1 (0.52)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL13145899	0.86	ALDH1A1 (0.60)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL3919839	0.86	ALDH1A1 (0.50)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL7204425	0.86	PTGS2 (0.50)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL14384259	0.86	ALDH1A1 (0.52)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL3928524	0.86	ALDH1A1 (0.50)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL5509506	0.86	ALDH1A1 (0.52)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL7204421	0.86	PTGS2 (0.50)	ALDH1A1KMT2AMAPTMAPK1MEN1
	SCHEMBL1013073	0.85	STAT3 (0.53)	ALDH1A1KMT2AMAPTMAPK1MEN1

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 (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.