SCHEMBL17859583

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
	SCHEMBL9079062	0.88	VCAM1 (0.40)	VCAM1CDK1CA1CA2CA9
	SCHEMBL19494504	0.87	CDK1 (0.38)	CDK1CA1CA2CA9CA5A
	SCHEMBL4278676	0.82	VCAM1 (0.40)	VCAM1CDK1CA1CA2CA9
	SCHEMBL4279013	0.82	VCAM1 (0.40)	VCAM1CDK1CA1CA2CA9
	SCHEMBL4267413	0.81	CA2 (0.42)	VCAM1CDK1CA1CA2CA9
	SCHEMBL9448542	0.80	VCAM1 (0.40)	VCAM1CDK1CA1CA2CA9
	SCHEMBL16825561	0.80	CCR2 (0.41)	VCAM1CA1CA2CA9CA5A
	SCHEMBL8132556	0.78	MAPT (0.41)	VCAM1CDK1CA1CA2CA9
	SCHEMBL9658540	0.78	SLC6A3 (0.35)	VCAM1ALDH1A1
	SCHEMBL8489410	0.76	VCAM1 (0.40)	VCAM1CDK1CA1CA2CA9

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 (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.