SCHEMBL950105

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
	SCHEMBL952038	0.89	ALDH1A1 (0.39)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL949358	0.86	ALDH1A1 (0.37)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL950305	0.85	MEN1 (0.49)	ALDH1A1KMT2AL3MBTL1MEN1LMNA
	SCHEMBL991215	0.84	ALDH1A1 (0.46)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL12705350	0.82	ALDH1A1 (0.38)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL949824	0.82	ALDH1A1 (0.37)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL12914674	0.81	MEN1 (0.33)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL12705355	0.80	ALDH1A1 (0.38)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL12605165	0.80	ALDH1A1 (0.40)	ALDH1A1THRBKMT2AL3MBTL1MEN1
	SCHEMBL13760459	0.80	—	—

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 10 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.