SCHEMBL2162369

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
	SCHEMBL5171104	0.83	PSEN1 (0.51)	CES2CES1SRD5A2PTPN1GSK3B
	SCHEMBL5171097	0.83	PSEN1 (0.51)	CES2CES1SRD5A2PTPN1GSK3B
	SCHEMBL2895507	0.81	CES2 (0.53)	CES2SRD5A2
	SCHEMBL14638979	0.80	CES2 (0.47)	CES2CES1SRD5A2PTPN1NR4A1
	SCHEMBL28252458	0.79	CES2 (0.48)	CES2CES1PTPN1NPC1RAB9A
	SCHEMBL12398654	0.77	CES2 (0.44)	CES2CES1SRD5A2PTPN1NR4A1
	SCHEMBL16401498	0.76	NPSR1 (0.50)	CES2CES1PTPN1GSK3BCYP1A1
	SCHEMBL993397	0.76	CES1 (0.46)	CES2CES1SRD5A2PTPN1MEN1
	SCHEMBL28464639	0.75	ALDH1A1 (0.52)	CES2CES1SRD5A2GSK3BNPC1
	SCHEMBL3140047	0.75	CES2 (0.48)	CES2CES1GSK3BCYP1B1RAB9A

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.