SCHEMBL4860657

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
	SCHEMBL4861134	0.93	PTGS2 (0.47)	PTGS2PTGS1CTNNB1WNT3ACA2
	SCHEMBL4852362	0.90	PTGS2 (0.42)	PTGS2PTGS1CTNNB1WNT3ANPC1
	SCHEMBL4859405	0.82	PTGS2 (0.48)	PTGS2PTGS1CTNNB1WNT3A
	SCHEMBL4855167	0.82	NPC1 (0.43)	PTGS2PTGS1CTNNB1WNT3ACA2
	SCHEMBL5308047	0.81	PTGS2 (0.47)	PTGS2PTGS1CTNNB1WNT3ACA2
	SCHEMBL5310504	0.81	NPC1 (0.37)	PTGS2PTGS1CTNNB1WNT3ACA2
	SCHEMBL5310834	0.80	PTGS1 (0.48)	PTGS2PTGS1CTNNB1WNT3ACA2
	SCHEMBL28753783	0.80	PTGS2 (0.51)	PTGS2PTGS1CA2CA12CA1
	SCHEMBL4855311	0.79	AKT1 (0.37)	PTGS2PTGS1CA2
	SCHEMBL4860602	0.79	PTGS2 (0.47)	PTGS2PTGS1

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 9 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.