SCHEMBL531982

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
	SCHEMBL25676224	0.86	HDAC3 (0.56)	ITGB3ITGA2BALDH1A1USP2TSHR
	SCHEMBL16809277	0.83	HDAC3 (0.74)	TSHRHSD17B10HDAC3HDAC8AURKA
	SCHEMBL532079	0.83	ALDH1A1 (0.59)	ITGB3ITGA2BALDH1A1USP2TSHR
	SCHEMBL25678729	0.80	HDAC3 (0.74)	ALDH1A1USP2TSHRHSD17B10HDAC3
	SCHEMBL8551200	0.80	ALDH1A1 (0.59)	ALDH1A1USP2TSHRHSD17B10ADRB1
	SCHEMBL532364	0.79	PARP1 (0.51)	OPRD1HSP90AB1ADRB1PARP1HTR3E
	SCHEMBL22912806	0.79	PARP1 (0.53)	OPRD1HSD17B10HDAC3HSP90AB1PARP1
	SCHEMBL532249	0.79	PARP1 (0.51)	OPRD1HSP90AB1PARP1
	SCHEMBL25803069	0.79	ALDH1A1 (0.63)	ITGB3ITGA2BALDH1A1USP2TSHR
	SCHEMBL6125261	0.79	CTSK (0.56)	ITGB3ITGA2BALDH1A1USP2TSHR

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 60 patents — showing the first 20. 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.