SCHEMBL380747

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
	SCHEMBL379655	0.98	AHR (0.42)	AHRKDM4ECYP2A6PARP1PTGES
	SCHEMBL17771886	0.89	CYP2A6 (0.40)	AHRKDM4ECYP2A6ALDH1A1MAPT
	SCHEMBL12205410	0.89	PARP1 (0.41)	AHRCYP2A6PARP1ALDH1A1SMN1; SMN2
	SCHEMBL19977161	0.86	AHR (0.54)	AHRKDM4ECYP2A6PARP1PTGES
	SCHEMBL21764494	0.86	AHR (0.54)	AHRKDM4ECYP2A6PARP1PTGES
	SCHEMBL9174497	0.86	AHR (0.54)	AHRKDM4ECYP2A6PARP1PTGES
	SCHEMBL28570139	0.86	ALDH1A1 (0.45)	AHRKDM4ECYP2A6ALDH1A1MEN1
	SCHEMBL17658578	0.85	CYP2D6 (0.49)	AHRKDM4ECYP2A6ALDH1A1CYP2D6
	SCHEMBL31514546	0.83	CYP2A6 (0.45)	AHRKDM4ECYP2A6ALDH1A1MAPT
	SCHEMBL28573559	0.83	CYP2A6 (0.45)	AHRKDM4ECYP2A6ALDH1A1MAPT

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 19 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.