SCHEMBL21628770

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
	SCHEMBL21628705	0.93	ALDH1A1 (0.49)	ALDH1A1HPGDNPSR1MAPTKDM4E
	SCHEMBL21628909	0.91	ALDH1A1 (0.48)	ALDH1A1HPGDNPSR1MAPTKDM4E
	SCHEMBL21628850	0.90	ALDH1A1 (0.51)	ALDH1A1HPGDNPSR1MAPTKDM4E
	SCHEMBL21628831	0.90	MAPT (0.55)	ALDH1A1HPGDNPSR1MAPTKDM4E
	SCHEMBL21628412	0.87	ALDH1A1 (0.66)	ALDH1A1HPGDNPSR1MAPTKDM4E
	SCHEMBL21628422	0.86	IGFBP3 (0.42)	MAPTKDM4ELMNAIGFBP3MAPK1
	SCHEMBL21628649	0.86	HPGD (0.51)	HPGDMAPTKDM4EIGFBP3MAPK1
	SCHEMBL21628513	0.85	IGFBP3 (0.52)	MAPTKDM4ELMNAIGFBP3MAPK1
	SCHEMBL21628839	0.85	OPRM1 (0.45)	MAPTKDM4EIGFBP3MAPK1SCN8A
	SCHEMBL21628807	0.84	PARP10 (0.54)	ALDH1A1MAPTKDM4EIGFBP3KMT2A

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 (7 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.