SCHEMBL1102946

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
	SCHEMBL16433702	0.89	HSP90AA1 (0.45)	ALDH1A1HSP90AA1L3MBTL1NPC1CCR1
	SCHEMBL1103081	0.83	L3MBTL1 (0.42)	ALDH1A1HSP90AA1L3MBTL1NPC1KDM4E
	SCHEMBL1103115	0.83	L3MBTL1 (0.42)	ALDH1A1HSP90AA1L3MBTL1NPC1KDM4E
	SCHEMBL1103109	0.83	L3MBTL1 (0.42)	ALDH1A1HSP90AA1L3MBTL1NPC1KDM4E
	SCHEMBL1103120	0.83	L3MBTL1 (0.42)	ALDH1A1HSP90AA1L3MBTL1NPC1KDM4E
	SCHEMBL1102913	0.83	TOP1 (0.38)	ALDH1A1HSP90AA1L3MBTL1NPC1TOP1
	SCHEMBL1103074	0.83	CYP17A1 (0.45)	ALDH1A1HSP90AA1L3MBTL1NPC1CCR1
	SCHEMBL1102860	0.83	CYP17A1 (0.45)	ALDH1A1HSP90AA1L3MBTL1NPC1CCR1
	SCHEMBL1103108	0.82	ESR1 (0.41)	ALDH1A1HSP90AA1L3MBTL1NPC1CCR1
	SCHEMBL1103113	0.82	ESR1 (0.41)	ALDH1A1HSP90AA1L3MBTL1NPC1CCR1

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 5 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.