SCHEMBL1593436

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
	SCHEMBL1594029	0.88	HDAC4 (0.51)	PDK2ERN1ALDH1A1HDAC3HDAC4
	SCHEMBL1593440	0.84	ALDH1A1 (0.59)	PDK2KEAP1NFE2L2ERN1CECR2
	SCHEMBL1593692	0.81	PDK2 (0.47)	PDK2KEAP1NFE2L2ERN1ALDH1A1
	SCHEMBL1594389	0.80	KEAP1 (0.45)	PDK2KEAP1NFE2L2ERN1CECR2
	SCHEMBL1593816	0.79	HDAC4 (0.53)	PDK2ALDH1A1HDAC3HDAC4HDAC1
	SCHEMBL1594451	0.76	ALDH1A1 (0.72)	ALDH1A1HDAC3HDAC4HDAC1HDAC7
	SCHEMBL5597962	0.76	HDAC6 (0.54)	ALDH1A1HDAC3HDAC4HDAC1HDAC7
	SCHEMBL1594408	0.74	ALDH1A1 (0.42)	KEAP1NFE2L2ALDH1A1HDAC3HDAC4
	SCHEMBL1594803	0.72	KEAP1 (0.44)	PDK2KEAP1NFE2L2ERN1HDAC3
	SCHEMBL1593873	0.71	NPC1 (0.44)	PDK2KEAP1NFE2L2ERN1HDAC3

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 20 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 (3 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.