SCHEMBL1680417

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
	SCHEMBL27968331	0.89	CALM1 (0.58)	LOXL2CALM1ALDH1A1HPGDALOX5
	SCHEMBL17800248	0.83	HTR2A (0.52)	CYP2A6LOXL2CALM1MAOAALDH1A1
	SCHEMBL1680761	0.79	LOXL2 (0.52)	CYP2A6CYP2E1CYP3A4CYP2C9CYP2B6
	SCHEMBL27968338	0.78	TP53 (0.48)	CYP3A4CALM1ALDH1A1HPGDALOX5
	SCHEMBL5108763	0.78	TSHR (0.48)	CYP2A6CALM1ALDH1A1HPGDALOX5
	SCHEMBL10789831	0.78	CALM1 (0.46)	CALM1MAOAALDH1A1HPGDALOX5
	SCHEMBL1680878	0.77	TAAR1 (0.50)	CYP2A6CYP2E1CYP3A4CYP2C9CYP2B6
	SCHEMBL27968335	0.77	CYP2E1 (0.62)	CYP2A6CYP2E1CYP3A4CYP2C9CYP2B6
	SCHEMBL1680462	0.77	PNMT (0.58)	CYP2A6CYP2E1CYP3A4CYP2C9CYP2B6
	(Z)-1,2-Diphenylethene SCHEMBL28198243	0.77	CALM1 (0.44)	CYP2C9CALM1MAOAALDH1A1HPGD

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 12 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 (3 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.