SCHEMBL3455898

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
	SCHEMBL3455080	0.86	ADORA2A (0.61)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL3457651	0.86	ADORA2A (0.61)	ADORA2AADORA1ADORA2BADORA3PIK3CD
	SCHEMBL3456132	0.84	ADORA2A (0.59)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL3456258	0.84	ADORA2A (0.58)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL3457265	0.84	ADORA2A (0.58)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL3456390	0.83	ADORA2A (0.51)	ADORA2AADORA1ADORA2BKDM4EMEN1
	SCHEMBL3455329	0.83	ADORA2A (0.58)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL3456812	0.83	ADORA2A (0.57)	ADORA2AADORA1ADORA2BADORA3
	SCHEMBL1553927	0.83	ADORA2A (1.00)	ADORA2AADORA1ADORA2BADORA3KDM4E
	SCHEMBL3455904	0.82	ADORA2A (0.57)	ADORA2AADORA1ADORA2BADORA3

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 9 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.