SCHEMBL4020440

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
	SCHEMBL3804451	0.91	ALDH1A1 (0.59)	ALDH1A1CYP2C9KDM4EMAPTCYP1A2
	SCHEMBL2010909	0.82	FFAR1 (0.50)	ALDH1A1CYP2C9KDM4EMAPTL3MBTL1
	SCHEMBL4021020	0.78	KDR (0.60)	ALDH1A1CYP2C9MAPTCYP1A2KDR
	SCHEMBL4019580	0.78	ALDH1A1 (0.51)	ALDH1A1CYP2C9MAPTCYP1A2KDR
	SCHEMBL14890349	0.78	KDM4E (0.62)	ALDH1A1KDM4EMAPTCYP1A2L3MBTL1
	SCHEMBL14676586	0.78	ALDH1A1 (0.50)	ALDH1A1CYP2C9KDM4EMAPTCYP1A2
	SCHEMBL4020308	0.77	KDR (0.71)	KDM4EMAPTKDRTSHRSMN1; SMN2
	SCHEMBL13058357	0.77	HDAC6 (0.56)	ALDH1A1CYP2C9KDM4EMAPTKDR
	SCHEMBL17022254	0.77	ALDH1A1 (0.50)	ALDH1A1CYP2C9KDM4EMAPTCYP1A2
	SCHEMBL27435770	0.76	KDM4E (0.60)	ALDH1A1KDM4EMAPTCYP1A2L3MBTL1

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 21 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 (3 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.