SCHEMBL3398649

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
	SCHEMBL8009971	0.91	ENPP2 (0.42)	HDAC1ENPP2GRM2CTSSCTSK
	SCHEMBL26508626	0.85	HDAC1 (0.56)	HDAC1GRM2CTSSCTSKBRD4
	SCHEMBL16410213	0.83	HDAC1 (0.48)	HDAC1ENPP2GRM2CTSSCTSK
	SCHEMBL29952891	0.81	GLS (0.52)	HDAC1GRM2BRD4CREBBPGLS
	SCHEMBL209838	0.81	GLS (0.52)	HDAC1GRM2BRD4CREBBPGLS
	SCHEMBL6243284	0.81	HDAC1 (0.51)	HDAC1GRM2CTSSCTSKBRD4
	SCHEMBL12053374	0.79	TACR1 (0.41)	HDAC1ENPP2GRM2CTSSCTSK
	SCHEMBL12791343	0.78	GRM2 (0.46)	HDAC1GRM2CTSSCTSKGLS
	SCHEMBL18664572	0.78	GRM2 (0.54)	HDAC1GRM2CTSSCTSKBRD4
	SCHEMBL30504293	0.77	HDAC1 (0.56)	HDAC1CTSSCTSKBRD4CREBBP

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 23 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.