SCHEMBL3817784

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
	SCHEMBL3829896	0.88	NR1I2 (0.59)	NR1I2CYP19A1ESR1ESR2CYP3A4
	SCHEMBL4620166	0.88	CYP19A1 (0.89)	NR1I2CYP19A1ESR1ESR2CYP3A4
	SCHEMBL11370966	0.88	CYP19A1 (0.89)	NR1I2CYP19A1ESR1ESR2CYP3A4
	SCHEMBL3813077	0.88	CYP19A1 (0.89)	NR1I2CYP19A1ESR1ESR2CYP3A4
	SCHEMBL4620164	0.88	CYP19A1 (0.89)	NR1I2CYP19A1ESR1ESR2CYP3A4
	SCHEMBL31167386	0.82	CYP19A1 (1.00)	CYP19A1ESR1ESR2CYP3A4CYP1A2
	SCHEMBL14391816	0.81	CYP19A1 (0.67)	NR1I2CYP19A1ESR1ESR2CYP3A4
	SCHEMBL77535	0.81	ALDH1A1 (0.60)	NR1I2ESR2CYP3A4MAPTDRD2
	SCHEMBL10780099	0.80	PTGS2 (0.76)	NR1I2CYP19A1ESR1ESR2CYP3A4
	SCHEMBL10777096	0.80	ESR1 (0.75)	NR1I2CYP19A1ESR1ESR2CYP3A4

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 9 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.