SCHEMBL2219635

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
	SCHEMBL2265917	0.94	CYP2A6 (0.50)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	Anthracene SCHEMBL27943251	0.92	CYP2A6 (0.48)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL17967021	0.90	ALDH1A1 (0.44)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL29886729	0.89	ALDH1A1 (0.55)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL198719	0.89	ALDH1A1 (0.55)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL14092891	0.86	CYP2A6 (0.44)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL27569032	0.86	CYP2A6 (0.48)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL1155242	0.83	ESR1 (0.53)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL1155657	0.82	ALDH1A1 (0.48)	ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
	SCHEMBL28511	0.82	ALDH1A1 (0.44)	ALDH1A1HSD17B10CYP2A6POLBTSHR

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 21 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 (7 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.