SCHEMBL580658

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
	SCHEMBL31240726	1.00	ENPP3 (0.48)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL24319665	0.84	BUB1 (0.39)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL29128021	0.84	BUB1 (0.39)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL25703228	0.83	BUB1 (0.38)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL29522590	0.83	PIK3CA (0.38)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL2792837	0.83	HSP90AA1 (0.39)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL138212	0.83	PIK3CA (0.38)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL30991728	0.83	BUB1 (0.38)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL31330402	0.83	HSP90AA1 (0.37)	ENPP3ENPP1HSP90AA1HSP90AB1POLB
	SCHEMBL1457357	0.83	HSP90AA1 (0.37)	ENPP3ENPP1HSP90AA1HSP90AB1POLB

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 34 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 (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.