SCHEMBL754646

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
	SCHEMBL4633234	0.82	TSHR (0.56)	TSHRS100A4APPCES2CES1
	SCHEMBL1266868	0.80	CES2 (0.41)	APPCES2CES1KCNN4ALDH1A1
	SCHEMBL9328858	0.80	CYP3A4 (0.46)	TSHRNOS3NOS1ALDH1A1MAPT
	SCHEMBL7036611	0.80	ALDH1A1 (0.46)	TSHRCES2CES1ALDH1A1MAPT
	SCHEMBL5663915	0.80	ESR1 (0.41)	TSHRAPPNOS3ALDH1A1MAPT
	SCHEMBL5736585	0.78	APP (0.41)	APPALDH1A1MAPTCA1CA2
	SCHEMBL19527562	0.78	NOS3 (0.39)	TSHRS100A4APPNOS3NOS1
	SCHEMBL28228853	0.78	MAPT (0.44)	TSHRS100A4APPNOS3NOS1
	SCHEMBL7032266	0.78	MAPT (0.42)	TSHRCES2CES1NOS1ALDH1A1
	SCHEMBL10441524	0.78	MT-CO2 (0.46)	TSHRCES2CES1ALDH1A1MEN1

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 10 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.