SCHEMBL558717

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
	SCHEMBL30244749	0.81	PDPK1 (0.38)	PDPK1FGFR1SRCNOS3NOS1
	SCHEMBL21827959	0.81	PDPK1 (0.38)	PDPK1FGFR1SRCNOS3NOS1
	SCHEMBL2551440	0.81	PDPK1 (0.38)	PDPK1FGFR1SRCNOS3NOS1
	SCHEMBL1823549	0.81	NOS3 (0.45)	SCN2APDPK1FGFR1SRCALDH1A1
	SCHEMBL20516618	0.77	TTR (0.36)	PDPK1FGFR1SRCPIK3CB
	SCHEMBL6844958	0.76	CYP1A2 (0.41)	ALDH1A1
	SCHEMBL2748634	0.76	ALDH1A1 (0.39)	SCN2AALDH1A1EGFRGRIN1PLAU
	SCHEMBL1396984	0.74	PDPK1 (0.53)	PDPK1FGFR1SRCNOS1PIK3CB
	SCHEMBL20517964	0.72	GABRP (0.37)	MAP4K1
	SCHEMBL20519515	0.72	PDPK1 (0.41)	PDPK1FGFR1SRCNOS3NOS1

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 40 patents — showing the first 20. 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 (5 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.