SCHEMBL62958

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
	SCHEMBL27382829	0.91	ALDH1A1 (0.40)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL25142186	0.89	CYP2D6 (0.37)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL27382276	0.89	CYP2D6 (0.37)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL12216017	0.89	CYP2D6 (0.54)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL27382273	0.88	CYP2D6 (0.39)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL19731033	0.88	CHRM2 (0.43)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL27382601	0.88	NAAA (0.42)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL16316503	0.83	CHRNB2 (0.41)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1
	SCHEMBL3901813	0.83	CHRM1 (0.58)	LMNACYP1A2CYP3A4ALDH1A1SMN1; SMN2
	SCHEMBL13693060	0.82	CYP2D6 (0.45)	CYP2D6LMNACYP1A2CYP3A4ALDH1A1

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 764 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 (1 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.