SCHEMBL120728

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
	SCHEMBL30434826	1.00	ALDH1A1 (0.44)	ALDH1A1HPGDMAPTALOX15HSD17B10
	SCHEMBL30434511	0.83	BRD4 (0.55)	ALDH1A1HPGDMAPTALOX15HSD17B10
	SCHEMBL122130	0.83	BRD4 (0.55)	ALDH1A1HPGDMAPTALOX15HSD17B10
	SCHEMBL378324	0.82	NPC1 (0.46)	ALDH1A1HPGDMAPTALOX15HSD17B10
	SCHEMBL148469	0.82	ALDH1A1 (0.50)	ALDH1A1HPGDMAPTHSD17B10KDM4E
	SCHEMBL148227	0.77	TNKS (0.50)	MAPTGAABRD4TNKSPARP1
	SCHEMBL147895	0.77	TNKS (0.50)	ALDH1A1HPGDMAPTKDM4EMEN1
	SCHEMBL121937	0.77	TNKS (0.48)	ALDH1A1HPGDMAPTKDM4EMEN1
	SCHEMBL145517	0.75	IP6K1 (0.45)	BRD4TNKSPARP1TNKS2RAB9A
	SCHEMBL30434323	0.75	IP6K1 (0.45)	BRD4TNKSPARP1TNKS2RAB9A

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 37 patents — showing the first 20. 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 (4 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.