SCHEMBL580833

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
	SCHEMBL580394	0.83	NCOA1 (0.54)	CLK1GSK3BCDK5CDK5R1MEN1
	SCHEMBL28501185	0.83	HSP90AA1 (0.53)	CLK1GSK3BCDK5CDK5R1ALDH1A1
	SCHEMBL30507528	0.83	HSP90AA1 (0.53)	CLK1GSK3BCDK5CDK5R1ALDH1A1
	SCHEMBL1264982	0.82	LMNA (0.42)	LMNAHTTRAB9ACDK5CDK5R1
	SCHEMBL1264960	0.82	PIK3CA (0.48)	LMNAHTTRAB9AGSK3BMAPT
	SCHEMBL1264807	0.81	IKBKB (0.43)	LMNAHTTRAB9AMAPTALDH1A1
	SCHEMBL27736350	0.81	HSPB1 (0.44)	LMNAHTTRAB9AMAPTALDH1A1
	SCHEMBL9087468	0.78	HSPB1 (0.59)	LMNAHTTRAB9AMAPTALDH1A1
	SCHEMBL4936375	0.76	ROCK1 (0.54)	CLK1ROCK1LMNAHTTRAB9A
	SCHEMBL30507248	0.74	CDK5 (0.66)	CLK1GSK3BCDK5CDK5R1ALDH1A1

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 12 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 (4 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.