SCHEMBL3781267

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
	SCHEMBL3789429	0.83	CYP3A4 (0.48)	SLC6A2SLC6A4SLC6A3CYP3A4ALDH1A1
	SCHEMBL11206840	0.82	ALDH1A1 (0.47)	SLC6A2SLC6A4SLC6A3CYP3A4ALDH1A1
	SCHEMBL3795007	0.80	HPGD (0.41)	SLC6A4CYP3A4ALDH1A1ALOX15SMN1; SMN2
	SCHEMBL18793099	0.78	ITGB2 (0.47)	CYP3A4ALDH1A1ALOX15SMN1; SMN2HPGD
	SCHEMBL110557	0.78	ALDH1A1 (0.52)	SLC6A2SLC6A4SLC6A3CYP3A4ALDH1A1
	SCHEMBL9629853	0.78	SLC6A2 (0.57)	SLC6A2SLC6A4SLC6A3CYP3A4ALDH1A1
	SCHEMBL30811359	0.78	ALDH1A1 (0.56)	SLC6A2SLC6A4SLC6A3CYP3A4ALDH1A1
	SCHEMBL866005	0.78	ALDH1A1 (0.56)	SLC6A2SLC6A4SLC6A3CYP3A4ALDH1A1
	SCHEMBL16676224	0.78	SLC6A4 (0.40)	SLC6A2SLC6A4SLC6A3ALDH1A1SMN1; SMN2
	SCHEMBL8781138	0.78	SLC6A2 (0.44)	SLC6A2SLC6A4SLC6A3CYP3A4ALDH1A1

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 25 patents — showing the first 20. 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.