SCHEMBL3036402

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
	Trifluoroacetic Acid SCHEMBL3022142	0.95	CYP3A4 (0.39)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1
	SCHEMBL3033597	0.91	CYP3A4 (0.41)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1
	SCHEMBL3027159	0.88	CYP3A4 (0.54)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1
	SCHEMBL3017381	0.88	CYP3A4 (0.49)	CYP3A4KCNH2CYP2C9CYP2C19PKM
	SCHEMBL3027526	0.88	CYP3A4 (0.46)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1
	Trifluoroacetic Acid SCHEMBL3028190	0.87	CYP3A4 (0.39)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1
	SCHEMBL3023960	0.87	CYP3A4 (0.43)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1
	SCHEMBL3023375	0.86	CYP3A4 (0.45)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1
	SCHEMBL3036184	0.85	CYP3A4 (0.44)	CYP3A4KCNH2CYP2C9CYP2C19PKM
	SCHEMBL3032846	0.85	CYP3A4 (0.44)	CYP3A4KCNH2CYP2C9CYP2C19EPAS1

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 12 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 (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.