SCHEMBL2536640

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
	SCHEMBL29954181	0.86	CYP2A6 (0.54)	CYP2A6IMPDH2PIM1PIM3PIM2
	SCHEMBL671445	0.86	CYP2A6 (0.54)	CYP2A6IMPDH2MAPK9CLK4PIM1
	SCHEMBL15332050	0.83	CYP2A6 (0.51)	CYP2A6IMPDH2CLK4PIM1PIM3
	SCHEMBL1430067	0.82	ALDH1A1 (0.50)	CYP2A6IMPDH2PLK4PARP1CDK4
	SCHEMBL29956756	0.82	CYP2A6 (0.50)	CYP2A6IMPDH2PIM1PIM3PIM2
	SCHEMBL10622395	0.82	CYP2A6 (0.50)	CYP2A6IMPDH2PIM1PIM3PIM2
	SCHEMBL1429453	0.81	CYP2A6 (0.49)	CYP2A6IMPDH2PLK4AKT3PIM1
	SCHEMBL15331057	0.81	CYP2A6 (0.55)	CYP2A6IMPDH2HTR2APIM1PIM3
	SCHEMBL7331481	0.80	CYP2A6 (0.46)	CYP2A6IMPDH2PARP1NPC1RAB9A
	SCHEMBL29952428	0.78	CYP2A6 (0.70)	CYP2A6IMPDH2PIM1PIM3PIM2

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 10 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 (3 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.