SCHEMBL2754745

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
	SCHEMBL9814678	0.85	PGK1 (0.41)	SLC6A3TP53TDP1ALDH1A1PGK1
	SCHEMBL7651096	0.78	ADRB1 (0.48)	SLC6A3CYP3A4TDP1ALDH1A1RAB9A
	SCHEMBL1080740	0.78	TP53 (0.52)	TP53TDP1ALDH1A1PGK1PGK2
	SCHEMBL27994438	0.77	CYP2D6 (0.39)	SLC6A3CYP2D6CYP3A4SLC6A2SLC6A4
	SCHEMBL11605816	0.76	CYP2D6 (0.47)	SLC6A3CYP2D6CYP3A4SLC6A2SLC6A4
	SCHEMBL9016042	0.76	CYP2D6 (0.41)	SLC6A3CYP2D6CYP3A4SLC6A2SLC6A4
	SCHEMBL2491629	0.76	CYP2D6 (0.41)	SLC6A3CYP2D6CYP3A4SLC6A2SLC6A4
	SCHEMBL6752527	0.76	TP53 (0.55)	TP53TDP1ALDH1A1PTGS2
	SCHEMBL907672	0.76	ACP3 (0.43)	SLC6A2SLC6A4ALDH1A1CYP1A2MEN1
	SCHEMBL29748919	0.76	CES2 (0.47)	SLC6A2SLC6A4

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 29 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 (6 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.