SCHEMBL12722008

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
	SCHEMBL16627120	0.96	CYP2A6 (0.50)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL5571565	0.94	CYP2A6 (0.52)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL13136843	0.94	CYP2A6 (0.52)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL5823395	0.94	ACHE (0.46)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL30670629	0.92	CYP2A6 (0.54)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL14505881	0.92	CYP2A6 (0.54)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL7169458	0.92	ALDH1A1 (0.48)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL10065551	0.92	ALDH1A1 (0.48)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL13017732	0.92	ALDH1A1 (0.48)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19
	SCHEMBL10039954	0.92	ALDH1A1 (0.48)	TDP1CYP1A2CYP3A4CYP2C9CYP2C19

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 35 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 (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.