SCHEMBL4083551

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
	SCHEMBL5746473	0.86	CA1 (0.47)	CA1CA2ALDH1A1CYP3A4HPGD
	SCHEMBL5749377	0.86	CA1 (0.47)	CA1CA2ALDH1A1CYP3A4HPGD
	SCHEMBL4084268	0.85	CA1 (0.53)	CA1CA2ALDH1A1CYP3A4HPGD
	Bromide SCHEMBL7338511	0.83	CA1 (0.51)	CA1CA2ALDH1A1CYP3A4HPGD
	SCHEMBL692894	0.81	ALDH1A1 (0.48)	CA1CA2ALDH1A1CYP3A4HPGD
	SCHEMBL38656851	0.80	CA1 (0.56)	CA1CA2SLC6A4SLC6A2SLC6A3
	SCHEMBL29489126	0.78	CA1 (0.55)	CA1CA2SLC6A4SLC6A2SLC6A3
	SCHEMBL818900	0.78	CA1 (0.55)	CA1CA2SLC6A4SLC6A2SLC6A3
	SCHEMBL4078176	0.78	CA1 (0.55)	CA1CA2ALDH1A1CYP3A4HPGD
	SCHEMBL5748854	0.78	CA1 (0.59)	CA1CA2ALDH1A1HPGDTSHR

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 (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.