SCHEMBL2584456

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
	SCHEMBL4890935	0.84	CYP3A4 (0.47)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10
	SCHEMBL11628857	0.83	ALDH1A1 (0.48)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10
	SCHEMBL5688510	0.82	ALDH1A1 (0.47)	CYP3A4NPSR1ALDH1A1MAPTSMN1; SMN2
	SCHEMBL27609022	0.82	CYP3A4 (0.49)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10
	SCHEMBL203679	0.82	ALDH1A1 (0.61)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10
	SCHEMBL788672	0.81	EGFR (0.48)	HCAR2GLAEGFRERBB2ALDH1A1
	SCHEMBL27505022	0.81	CYP3A4 (0.44)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10
	Hydrochloric Acid SCHEMBL25259767	0.80	ALDH1A1 (0.59)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10
	SCHEMBL14551016	0.80	CYP3A4 (0.43)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10
	SCHEMBL17386357	0.79	CYP3A4 (0.50)	CYP3A4NPSR1ALDH1A1TSHRHSD17B10

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 14 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.