SCHEMBL4035679

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
	SCHEMBL5203371	0.82	CYP1A2 (0.43)	CYP1A2CYP3A4MAPTUSP2MAPK1
	SCHEMBL13909020	0.77	CYP1A2 (0.40)	CYP1A2CYP3A4MAPTIDO1USP2
	SCHEMBL1614223	0.76	PTGS2 (0.42)	CYP3A4MAPTERN1TUBB4ATUBB
	SCHEMBL1942567	0.76	PTPN1 (0.41)	CYP1A2CYP3A4MAPTUSP2MAPK1
	SCHEMBL5203651	0.75	CYP1A2 (0.48)	CYP1A2CYP3A4MAPTTUBB4ATUBB
	SCHEMBL20817223	0.74	ALDH1A1 (0.46)	CYP1A2CYP3A4MAPTIDO1SMN1; SMN2
	SCHEMBL5207796	0.71	CYP3A4 (0.52)	CYP1A2CYP3A4MAPTERN1TUBB4A
	Water SCHEMBL27608785	0.69	CYP1A2 (0.42)	CYP1A2CYP3A4IDO1USP2MAPK1
	SCHEMBL20815990	0.69	PRKCE (0.50)	CYP3A4MAPTMAPK1ALOX5CYP1A1
	SCHEMBL5203576	0.69	TNFRSF1A (0.45)	CYP3A4MAPTMAPK1SMN1; SMN2TUBB4A

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 7 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 (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.