SCHEMBL1016676

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
	SCHEMBL1020102	0.91	PARP1 (0.37)	HRH3PARP1MAPK14KCNH2KDM4E
	SCHEMBL1014265	0.89	HRH3 (0.38)	HRH3PARP1KCNH2KDM4EALDH1A1
	SCHEMBL1017368	0.89	HRH3 (0.38)	HRH3PARP1KCNH2KDM4EALDH1A1
	SCHEMBL1020298	0.88	HRH3 (0.49)	HRH3PARP1KDM4EALDH1A1
	SCHEMBL1069967	0.88	PANK3 (0.41)	HRH3PANK3PARP1KDM4EALDH1A1
	SCHEMBL1016604	0.86	PARP1 (0.38)	HRH3PARP1MAPK14KCNH2KDM4E
	SCHEMBL1020897	0.82	HRH3 (0.38)	HRH3PANK3PARP1KCNH2KDM4E
	SCHEMBL1018775	0.82	HRH3 (0.38)	HRH3PARP1KCNH2KDM4EALDH1A1
	SCHEMBL1016572	0.81	HRH3 (0.42)	HRH3PARP1KCNH2KDM4EALDH1A1
	SCHEMBL1017334	0.81	PDK2 (0.48)	HRH3KCNH2

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 13 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 (2 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.