SCHEMBL2413686

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
	SCHEMBL2412557	0.98	MAP4K4 (0.51)	MAP4K4SMPD3CNR2MAPTALDH1A1
	Hydrochloric Acid SCHEMBL6337864	0.96	MAP4K4 (0.50)	MAP4K4SMPD3CNR2MAPTALDH1A1
	SCHEMBL2417923	0.81	HTR3A (0.59)	MAP4K4ALDH1A1CYP1A2HRH4
	SCHEMBL29546459	0.81	HRH3 (0.57)	ALDH1A1MAPK1TDP1CYP1A2HTT
	SCHEMBL29739643	0.81	SMPD3 (0.47)	MAP4K4SMPD3CNR2MAPTALDH1A1
	SCHEMBL25187814	0.81	CNR2 (0.52)	MAP4K4SMPD3CNR2MAPTALDH1A1
	SCHEMBL31570599	0.81	SMPD3 (0.53)	SMPD3MAPTALDH1A1POLBCRHBP
	SCHEMBL939415	0.81	SMPD3 (0.53)	SMPD3MAPTALDH1A1POLBCRHBP
	SCHEMBL4636410	0.81	SMPD3 (0.47)	MAP4K4SMPD3CNR2MAPTALDH1A1
	SCHEMBL29757651	0.81	HTR3A (0.59)	MAP4K4ALDH1A1CYP1A2HRH4

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 (1 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.