SCHEMBL4128975

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
	SCHEMBL13651702	0.85	CYP1A2 (0.48)	CYP1A2TSHRCYP2C19AKT1AKT2
	SCHEMBL14391654	0.81	CYP1A2 (0.44)	CYP1A2TSHRCYP2C19MEN1ALDH1A1
	SCHEMBL4063885	0.81	CYP1A2 (0.56)	CYP1A2TSHRCYP2C19AKT1AKT2
	SCHEMBL4134543	0.76	CYP2C19 (0.57)	CYP1A2TSHRCYP2C19MEN1ALDH1A1
	SCHEMBL4068137	0.74	CYP1A2 (0.49)	CYP1A2TSHRCYP2C19MEN1ALDH1A1
	SCHEMBL4137893	0.73	CYP1A2 (0.54)	CYP1A2TSHRCYP2C19AKT2MEN1
	SCHEMBL4063305	0.72	CYP1A2 (0.53)	CYP1A2TSHRCYP2C19MEN1ALDH1A1
	SCHEMBL4122030	0.72	NPC1 (0.60)	CYP1A2TSHRCYP2C19AKT2PRKACA
	SCHEMBL4070092	0.72	NPC1 (0.54)	CYP1A2TSHRCYP2C19AKT2MEN1
	SCHEMBL22111670	0.72	CYP2C19 (0.52)	CYP1A2TSHRCYP2C19CYP3A4MEN1

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 1 patent. 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 (1 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.