SCHEMBL1780897

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
	SCHEMBL14403053	0.86	ESR2 (0.42)	ESR2TRPV3IKBKETBK1ESR1
	SCHEMBL6677219	0.83	ESR2 (0.37)	ESR2TRPV3IKBKETBK1ESR1
	Hydrochloric Acid SCHEMBL253113	0.82	ESR2 (0.36)	ESR2TRPV3IKBKETBK1ESR1
	SCHEMBL8990466	0.82	ESR2 (0.39)	ESR2TRPV3IKBKETBK1ESR1
	SCHEMBL25865053	0.81	DRD2 (0.44)	ESR2TRPV3IKBKETBK1ATP1A1
	SCHEMBL10131989	0.81	IKBKE (0.38)	ESR2IKBKETBK1C5AR1ALDH1A1
	SCHEMBL8383556	0.81	ESR2 (0.58)	ESR2ESR1CYP3A4CYP2C9
	SCHEMBL8451083	0.81	SPHK1 (0.43)	C5AR1ALDH1A1MEN1KMT2A
	SCHEMBL251729	0.78	ALDH1A1 (0.44)	IKBKETBK1CYP2C9C5AR1ALDH1A1
	SCHEMBL742590	0.78	ESR2 (0.52)	ESR2ESR1CYP3A4CYP2C9CYP19A1

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 5 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 (2 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.