SCHEMBL116594

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
	SCHEMBL15670462	1.00	TSHR (0.59)	TSHRTP53TDP1CYP3A4MEN1
	SCHEMBL19045670	0.86	TSHR (0.48)	TSHRTP53TDP1
	SCHEMBL12537071	0.85	TSHR (0.46)	TSHRTP53TDP1
	SCHEMBL144537	0.79	CYP3A4 (0.65)	TSHRCYP3A4
	SCHEMBL246817	0.78	TSHR (0.62)	TSHRTP53TDP1MEN1KMT2A
	SCHEMBL7112272	0.78	CYP3A4 (0.57)	TSHRTDP1CYP3A4
	Triethyl Phosphate SCHEMBL28023664	0.77	TSHR (1.00)	TSHRTP53TDP1CYP3A4MEN1
	Triethyl Phosphate SCHEMBL1332591	0.77	TSHR (1.00)	TSHRTP53TDP1CYP3A4MEN1
	Triethyl Phosphate SCHEMBL27822049	0.77	TSHR (1.00)	TSHRTP53TDP1CYP3A4MEN1
	Triethyl Phosphate SCHEMBL21887	0.77	TSHR (1.00)	TSHRTP53TDP1CYP3A4MEN1

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 17 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 (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.