SCHEMBL4095113

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
	SCHEMBL29678125	0.81	MEN1 (0.63)	ALDH1A1MEN1KMT2APKMCYP1B1
	SCHEMBL2959641	0.79	ALDH1A1 (1.00)	ALDH1A1MEN1KMT2APKMCYP1B1
	SCHEMBL30711693	0.79	ALDH1A1 (1.00)	ALDH1A1MEN1KMT2APKMCYP1B1
	SCHEMBL4230505	0.78	ALDH1A1 (0.64)	ALDH1A1MEN1KMT2APKMCYP1B1
	SCHEMBL28765158	0.78	ALDH1A1 (0.64)	ALDH1A1MEN1KMT2APKMCYP1B1
	SCHEMBL29678377	0.78	MEN1 (0.53)	ALDH1A1MEN1KMT2APKMCYP1B1
	SCHEMBL4095117	0.77	ALDH1A1 (0.77)	ALDH1A1MEN1KMT2APKMCYP1B1
	SCHEMBL10795639	0.75	DNMT1 (0.46)	ALDH1A1MEN1KMT2ACYP1B1HSD17B10
	SCHEMBL9327695	0.75	DNMT1 (0.46)	ALDH1A1MEN1KMT2ACYP1B1HSD17B10
	SCHEMBL12235635	0.75	CYP1B1 (0.53)	ALDH1A1MEN1KMT2ACYP1B1HSD17B10

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 14 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 (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.