SCHEMBL1699531

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
	SCHEMBL15099647	1.00	CYP3A4 (0.37)	CYP3A4HTTLMNAMAPTALDH1A1
	SCHEMBL1699594	0.92	PTGDR2 (0.40)	CYP3A4LMNAMAPTALDH1A1TDP1
	SCHEMBL1699367	0.89	CYP3A4 (0.47)	CYP3A4PSIP1MEN1KMT2APTGDR2
	SCHEMBL15165194	0.89	CYP3A4 (0.39)	CYP3A4ALDH1A1PSIP1MEN1KMT2A
	SCHEMBL10271691	0.87	CYP3A4 (0.39)	CYP3A4HTTLMNAMAPTALDH1A1
	SCHEMBL15099648	0.85	HTT (0.39)	HTTLMNAMAPTALDH1A1TDP1
	SCHEMBL1699639	0.85	HTT (0.39)	HTTLMNAMAPTALDH1A1TDP1
	SCHEMBL15165289	0.84	PSIP1 (0.39)	CYP3A4HTTLMNAMAPTALDH1A1
	SCHEMBL1699390	0.83	CYP3A4 (0.35)	CYP3A4LMNAMAPTALDH1A1TDP1
	SCHEMBL18892077	0.83	CYP3A4 (0.37)	CYP3A4PSIP1

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 13 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 (2 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.