SCHEMBL20401331

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
	SCHEMBL30401911	1.00	ALDH1A1 (0.38)	ALDH1A1NPC1HPGDHSD17B10MAPT
	SCHEMBL30401927	0.98	ALDH1A1 (0.36)	ALDH1A1NPC1HPGDHSD17B10MAPT
	SCHEMBL20401393	0.98	ALDH1A1 (0.36)	ALDH1A1NPC1HPGDHSD17B10MAPT
	SCHEMBL20436674	0.93	ALDH1A1 (0.40)	ALDH1A1NPC1HPGDHSD17B10MAPT
	SCHEMBL20436675	0.91	ALDH1A1 (0.38)	ALDH1A1NPC1HPGDHSD17B10MAPT
	SCHEMBL30400427	0.86	ADORA2A (0.41)	ADORA2AADORA1ADORA3ADORA2BCDC7
	SCHEMBL20400314	0.86	ADORA2A (0.41)	ADORA2AADORA1ADORA3ADORA2BCDC7
	SCHEMBL30401320	0.85	CDC7 (0.41)	ADORA2AADORA1ADORA3ADORA2BCDC7
	SCHEMBL20401421	0.85	CDC7 (0.41)	ADORA2AADORA1ADORA3ADORA2BCDC7
	SCHEMBL20401436	0.83	ADORA2A (0.41)	ADORA2AADORA1ADORA2BCDC7DAPK3

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 20 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 (6 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.