SCHEMBL1619909

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
	SCHEMBL17203693	0.85	ALDH1A1 (0.52)	CYP1A1CYP1B1ALDH1A1CYP2A6CYP1A2
	SCHEMBL23906958	0.85	ALDH1A1 (0.52)	CYP1A1CYP1B1ALDH1A1CYP2A6CYP1A2
	SCHEMBL1620823	0.83	ALDH1A3 (0.34)	CYP2A6KDM4E
	SCHEMBL228003	0.81	CYP1A1 (0.64)	CYP1A1CYP1B1ALDH1A1CYP2A6CYP1A2
	Water SCHEMBL28227114	0.79	CYP1A1 (0.61)	CYP1A1CYP1B1ALDH1A1CYP2A6CYP1A2
	SCHEMBL1621200	0.78	EGFR (0.33)	EGFR
	SCHEMBL1663786	0.77	ALDH1A1 (0.58)	CYP1A1CYP1B1ALDH1A1CYP2A6CYP1A2
	SCHEMBL18428478	0.77	ALDH1A1 (0.33)	ALDH1A1
	SCHEMBL22779349	0.77	ALDH1A3 (0.55)	CYP1A1CYP1B1ALDH1A1CYP2A6CYP1A2
	SCHEMBL17203257	0.77	ALDH1A1 (0.42)	CYP1A1CYP1B1ALDH1A1KMT2AMAPT

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 (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.