SCHEMBL22554746

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
	SCHEMBL22554699	0.86	ALDH1A1 (0.67)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL1392591	0.85	CYP3A4 (0.65)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL3827276	0.83	ESR2 (0.50)	ALDH1A1CYP3A4TDP1TSHRESR2
	SCHEMBL807863	0.83	ALDH1A1 (0.70)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL22554727	0.81	ALDH1A1 (0.67)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL22554778	0.78	ALDH1A1 (0.50)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL1918559	0.78	ALDH1A1 (0.54)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL8954034	0.76	ALDH1A1 (0.82)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL22517389	0.76	ALDH1A1 (0.52)	ALDH1A1CYP3A4TDP1TSHRTP53
	SCHEMBL7246163	0.76	CYP2A6 (0.46)	ALDH1A1CYP3A4TDP1ESR2CYP1A2

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 6 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.