SCHEMBL57683

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
	SCHEMBL309762	1.00	CYP3A4 (0.63)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	SCHEMBL2918640	1.00	CYP3A4 (0.63)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	SCHEMBL5173409	0.91	TBXAS1 (0.58)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	Methacrylic Acid SCHEMBL10714804	0.91	CYP3A4 (0.54)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	Oxirane SCHEMBL15646744	0.91	CYP3A4 (0.54)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	SCHEMBL9061442	0.89	TP53 (0.59)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	SCHEMBL15955486	0.88	CYP3A4 (0.55)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	SCHEMBL15955485	0.88	CYP3A4 (0.55)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	SCHEMBL5007835	0.88	CYP3A4 (0.51)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1
	SCHEMBL30752458	0.86	RECQL (0.70)	CYP3A4CYP2C9RECQLAKR1C3TBXAS1

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 724 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 (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.