SCHEMBL9978078

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
	SCHEMBL9977859	0.90	CYP3A4 (0.70)	CYP3A4CYP2D6TNKSMAPT
	SCHEMBL9977846	0.90	CYP3A4 (0.70)	CYP3A4CYP2D6TNKSMAPT
	SCHEMBL18022584	0.86	CYP3A4 (0.53)	CYP3A4CYP2D6TBXA2RCRHR1
	SCHEMBL9977927	0.85	CYP3A4 (0.87)	CYP3A4CYP2D6TNKSTSHRMAPT
	SCHEMBL9977919	0.83	CYP3A4 (0.60)	CYP3A4MAPT
	SCHEMBL15293726	0.82	CYP3A4 (0.54)	CYP3A4CYP2D6TBXA2RTNKSKDM4E
	SCHEMBL3822776	0.82	CYP3A4 (1.00)	CYP3A4CYP2D6TNKSKDM4ETSHR
	SCHEMBL29413237	0.82	CYP3A4 (1.00)	CYP3A4CYP2D6TNKSKDM4ETSHR
	SCHEMBL16696067	0.82	CYP3A4 (0.68)	CYP3A4CYP2D6TNKS
	SCHEMBL9977963	0.82	CYP3A4 (0.70)	CYP3A4CYP2D6TNKS

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 20 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.