SCHEMBL17829700

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
	SCHEMBL13525455	0.85	CA2 (0.50)	CA2CA12CA3CA4CA6
	SCHEMBL29617406	0.85	CA2 (0.50)	CA2CA12CA3CA4CA6
	SCHEMBL29749150	0.85	CA2 (0.54)	CA2CA12CA3CA4CA6
	SCHEMBL1206769	0.85	CA2 (0.54)	CA2CA12CA3CA4CA6
	SCHEMBL3039135	0.83	CA2 (0.52)	CA2CA12CA3CA4CA6
	SCHEMBL11661526	0.82	CYP2A6 (0.50)	CA2CA12CA3CA4CA6
	SCHEMBL23120387	0.79	IDO1 (0.38)	TTRIDO1CYP1A2CYP2A6PNMT
	SCHEMBL29519804	0.79	CYP1A2 (0.52)	CA2CA12CA3CA4CA6
	SCHEMBL3923568	0.79	CYP1A2 (0.52)	CA2CA12CA3CA4CA6
	SCHEMBL17138379	0.79	CA2 (0.50)	CA2CA12CA3CA4CA6

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 5 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.