SCHEMBL3455887

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
	SCHEMBL3455129	0.94	ADORA2A (0.43)	KDM4EALDH1A1MAPTHPGDRAB9A
	SCHEMBL3455120	0.90	ADORA2A (0.44)	ALDH1A1RAB9ANPC1ADORA2AADORA1
	SCHEMBL3455897	0.88	ADORA1 (0.45)	ADORA2AADORA1ADORA2B
	SCHEMBL3455963	0.84	ADORA2A (0.48)	KDM4EALDH1A1MAPTHPGDRAB9A
	SCHEMBL3456373	0.80	TLR8 (0.47)	KDM4EALDH1A1MAPTHPGDHSD17B10
	SCHEMBL3456160	0.78	ADORA2A (0.51)	KDM4EALDH1A1MAPTHPGDHSD17B10
	SCHEMBL3455078	0.77	ADORA2A (0.42)	ADORA2AADORA1ADORA2BPTPN7
	SCHEMBL3455793	0.77	ADORA2A (0.43)	ADORA2AADORA1ADORA2B
	SCHEMBL3455250	0.75	ADORA2A (0.49)	ADORA2AADORA1ADORA2B
	SCHEMBL3455554	0.75	ADORA2A (0.51)	KDM4EALDH1A1MAPTHPGDHSD17B10

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.