SCHEMBL3456013

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
	SCHEMBL3455951	0.89	ADORA2A (0.52)	ADORA2AADORA1ADORA2BADORA3ALDH1A1
	SCHEMBL3456009	0.86	ADORA2A (0.50)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL3456019	0.84	ADORA2A (0.44)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL3456687	0.84	TOP1 (0.48)	ADORA2AADORA1TOP1ADORA2BADORA3
	SCHEMBL3455192	0.84	ADORA2A (0.59)	ADORA2AADORA1ADORA2BADORA3ALDH1A1
	SCHEMBL3455327	0.81	ADORA2A (0.47)	ADORA2AADORA1ADORA2BADORA3ALDH1A1
	SCHEMBL3455807	0.81	ADORA2A (0.45)	ADORA2AADORA1ADORA2BADORA3ALDH1A1
	SCHEMBL3455910	0.80	ADORA2A (0.47)	ADORA2AADORA1ADORA2BADORA3ALDH1A1
	SCHEMBL3456160	0.76	ADORA2A (0.51)	ADORA2AADORA1ADORA2BALDH1A1POLB
	SCHEMBL3455589	0.72	ADORA2A (0.55)	ADORA2AADORA1ADORA2BADORA3ALDH1A1

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 (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.