SCHEMBL531814

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
	SCHEMBL16851396	1.00	PDK1 (0.46)	PDK1ALDH1A1ABCB1ABCC1MAPT
	SCHEMBL375062	0.89	ALDH1A1 (0.43)	PDK1ALDH1A1ABCB1ABCC1MAPT
	SCHEMBL374896	0.89	ALDH1A1 (0.43)	PDK1ALDH1A1ABCB1ABCC1MAPT
	SCHEMBL11439200	0.88	ALDH1A1 (0.47)	ALDH1A1ABCB1ABCC1MAPTMEN1
	SCHEMBL3792640	0.87	ALDH1A1 (0.45)	PDK1ALDH1A1MAPTMEN1POLB
	SCHEMBL16823536	0.86	PDK1 (0.48)	PDK1ALDH1A1ABCB1ABCC1MAPT
	SCHEMBL16823541	0.86	PDK1 (0.48)	PDK1ALDH1A1ABCB1ABCC1MAPT
	SCHEMBL12992431	0.85	TTR (0.50)	PDK1ALDH1A1MAPTMEN1KMT2A
	SCHEMBL30806568	0.85	ALDH1A1 (0.53)	PDK1ALDH1A1MAPTKMT2ALMNA
	SCHEMBL30806257	0.84	L3MBTL1 (0.48)	PDK1ALDH1A1MAPTMEN1KMT2A

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 9 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.