SCHEMBL404057

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
	SCHEMBL403865	0.89	ALDH1A1 (0.48)	PDE5ACSNK2A2CSNK2BCYP3A4HDAC6
	SCHEMBL27934621	0.85	KDM4E (0.56)	CYP3A4HDAC6HDAC8MAPT
	SCHEMBL401474	0.83	MBOAT4 (0.46)	PDE5ACSNK2A2CSNK2BCYP3A4HDAC6
	SCHEMBL38105	0.76	PDE5A (1.00)	PDE5ACSNK2A2CSNK2BCSNK2A1MAPT
	SCHEMBL6301370	0.73	NPC1 (0.45)	CYP3A4HDAC6HDAC1HDAC8MAPT
	SCHEMBL6922909	0.72	MAPK1 (0.51)	MAPT
	SCHEMBL7507339	0.72	MEN1 (0.56)	HDAC6HDAC1HDAC11HDAC8MAPT
	SCHEMBL31542051	0.72	HDAC6 (0.66)	CYP3A4HDAC6HDAC1HDAC11HDAC8
	SCHEMBL8614149	0.71	HDAC6 (0.70)	CYP3A4HDAC6HDAC8
	SCHEMBL400846	0.70	PDE5A (0.82)	PDE5ACSNK2A2CSNK2BCSNK2A1

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 16 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.