SCHEMBL2989628

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
	SCHEMBL2975042	0.94	ALDH1A1 (0.39)	ALDH1A1GAARAB9ASMN1; SMN2NPC1
	SCHEMBL2975976	0.85	DKK1 (0.41)	GSK3B
	SCHEMBL5147359	0.84	ALDH1A1 (0.45)	ALDH1A1GAARAB9ASMN1; SMN2NPC1
	SCHEMBL2984724	0.83	MAPK3 (0.37)	GSK3BRAF1BRAF
	SCHEMBL2982348	0.83	MEN1 (0.38)	ALDH1A1MEN1KMT2ABRAFMAPT
	SCHEMBL2974881	0.83	MAPK3 (0.39)	—
	SCHEMBL2983814	0.83	MAPK1 (0.37)	KDM4EGSK3BRAF1BRAFLMNA
	SCHEMBL2971966	0.82	EIF2AK2 (0.38)	RAF1BRAFERN1ABL1FGFR1
	SCHEMBL2974386	0.82	ALDH1A1 (0.41)	ALDH1A1HPGDCDK9RAF1BRAF
	SCHEMBL2975816	0.82	MAPK3 (0.38)	—

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 9 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 (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.