SCHEMBL4739458

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
	SCHEMBL4742706	0.87	MMP9 (0.48)	MMP9MMP2MMP13CA1CA2
	SCHEMBL4742717	0.84	MMP9 (0.57)	MMP9MMP2MMP13CA1CA2
	SCHEMBL4738597	0.83	HDAC3 (0.47)	MMP2CA1CA2CA9CCKBR
	SCHEMBL4742096	0.82	HDAC4 (0.50)	MMP2CA1CA2CA9ALDH1A1
	SCHEMBL4741450	0.82	MMP2 (0.51)	MMP9MMP2CA1CA2CA9
	SCHEMBL8171821	0.82	ALDH1A1 (0.43)	MMP2CA1CA2CA9ALDH1A1
	SCHEMBL4739485	0.82	MMP2 (0.48)	MMP9MMP2CA9ANPEPMEN1
	SCHEMBL4739513	0.82	HDAC8 (0.48)	MMP2CA2CA9ALDH1A1MEN1
	SCHEMBL4739412	0.81	HDAC8 (0.54)	MMP2HSD17B10MMP13CA1CA2
	SCHEMBL4738584	0.81	KDM4E (0.45)	MMP2CA1CA2CA9

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 6 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.