SCHEMBL3455545

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
	SCHEMBL3455250	0.94	ADORA2A (0.49)	ADORA2AADORA2BADORA1
	SCHEMBL3456249	0.93	ADORA2A (0.52)	ADORA2AADORA2BADORA1NQO2
	SCHEMBL3455800	0.89	ADORA2A (0.59)	ADORA2AADORA2BADORA1NQO2NPC1
	SCHEMBL3455976	0.87	ADORA2A (0.42)	ADORA2AADORA2BADORA1NQO2
	SCHEMBL3456004	0.86	ADORA2A (0.42)	ADORA2AADORA2BADORA1NQO2
	SCHEMBL3456687	0.85	TOP1 (0.48)	ADORA2AADORA2BADORA1NPC1RAB9A
	SCHEMBL3455565	0.85	ADORA2A (0.44)	ADORA2AADORA2BADORA1NPC1TSHR
	SCHEMBL3455589	0.84	ADORA2A (0.55)	ADORA2AADORA2BADORA1PIK3R1PIK3CA
	SCHEMBL3455110	0.83	ADORA2A (0.58)	ADORA2AADORA2BADORA1PIK3R1PIK3CA
	SCHEMBL3456009	0.82	ADORA2A (0.50)	ADORA2AADORA2BADORA1PIK3R1PIK3CA

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.