SCHEMBL1684663

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
	SCHEMBL409700	0.88	CDK2 (0.61)	CDK2CDK4CCNE1CACNA1BAPBA1
	SCHEMBL1684617	0.87	CDK2 (0.78)	CDK2CDK4CCNE1CACNA1BAPBA1
	SCHEMBL7981339	0.86	CDK2 (0.75)	CDK2CDK4CCNE1KDRPLK1
	SCHEMBL1684719	0.85	CDK2 (0.74)	CDK2CDK4CCNE1CACNA1BAPBA1
	SCHEMBL7978545	0.84	CDK2 (0.69)	CDK2CDK4CCNE1KDRPLK1
	SCHEMBL700587	0.84	CDK2 (0.69)	CDK2CDK4CCNE1KDRPLK1
	SCHEMBL1684643	0.83	CDK2 (0.86)	CDK2CDK4CCNE1KDRPTK2
	SCHEMBL1684709	0.81	CDK2 (0.83)	CDK2CDK4CCNE1CDK1PRKD3
	SCHEMBL1684885	0.81	CDK2 (0.83)	CDK2CDK4CCNE1CDK1PRKD3
	SCHEMBL1684889	0.81	CDK2 (1.00)	CDK2CDK4CCNE1KDRPLK1

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 (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.