SCHEMBL2986753

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
	SCHEMBL697719	0.80	TAAR1 (0.44)	HSD17B10CYP1A2ALDH1A1CHRNB4CHRNA3
	SCHEMBL727185	0.74	CYP1A2 (0.62)	CYP1A2CHRNB2CHRNA4HRH4HRH3
	SCHEMBL28951692	0.74	CYP1A2 (0.52)	CYP1A2CHRNB2CHRNA4HRH4HRH3
	SCHEMBL7115844	0.73	TAAR1 (0.56)	HSD17B10CYP1A2CHRNB2CHRNA4HRH4
	SCHEMBL20746327	0.71	CHRNB2 (0.43)	HSD17B10CYP1A2ALDH1A1THRBCHRNB2
	SCHEMBL1429748	0.69	ALOX15 (0.46)	ALDH1A1CYP2C19CHRNB4CHRNA3CYP2D6
	SCHEMBL7004570	0.69	TAAR1 (0.69)	CYP1A2CYP2D6
	SCHEMBL15293883	0.69	CHRNB2 (0.45)	ALDH1A1CHRNB2CHRNA4HRH3CYP19A1
	SCHEMBL14257669	0.69	CYP1A2 (0.56)	CYP1A2CHRNB2CHRNA4HRH4HRH3
	SCHEMBL29995759	0.69	CYP11B1 (0.65)	CYP1A2CYP2C19HRH4HRH3CYP2D6

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 3 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.