SCHEMBL17805201

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
	SCHEMBL17805250	1.00	CYP2A6 (0.52)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL30911058	0.96	CYP2A6 (0.55)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL15949874	0.96	CYP2A6 (0.55)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL17805254	0.91	NPC1 (0.46)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL17805262	0.89	CYP11B1 (0.50)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL17812852	0.89	NPC1 (0.43)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL17805219	0.88	PIK3CA (0.46)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL17812842	0.88	PIK3CA (0.46)	CYP2A6NPC1RAB9AMAPTALDH1A1
	SCHEMBL17812847	0.88	MAPT (0.45)	NPC1RAB9AMAPTALDH1A1CYP11B1
	SCHEMBL10018423	0.86	CYP11B2 (0.56)	CYP2A6NPC1RAB9AMAPTALDH1A1

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 10 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 (4 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.