SCHEMBL1016795

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
	SCHEMBL1016821	0.86	ALDH1A1 (0.45)	HRH3ALDH1A1KDM4EGAAPKM
	SCHEMBL1014267	0.85	HRH3 (0.39)	MEN1DRD3HRH3MGLLALDH1A1
	SCHEMBL1017287	0.84	FAAH (0.44)	MEN1HRH3ALDH1A1KDM4EGAA
	SCHEMBL1018194	0.83	ALDH1A1 (0.45)	MEN1HRH3ALDH1A1KDM4EGAA
	SCHEMBL1017314	0.83	USP30 (0.50)	MEN1HRH3ALDH1A1KDM4EGAA
	SCHEMBL1018644	0.82	ALDH1A1 (0.59)	MEN1HRH3ALDH1A1KDM4EGAA
	SCHEMBL1017172	0.82	KDM2B (0.45)	HRH3ALDH1A1KDM4EGAAPKM
	SCHEMBL12953017	0.82	ALDH1A1 (0.43)	MEN1HRH3ALDH1A1KDM4EGAA
	SCHEMBL12953076	0.81	HRH3 (0.44)	HRH3ALDH1A1KDM4EGAAPKM
	SCHEMBL1017588	0.81	MTNR1B (0.52)	HRH3ALDH1A1

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.