SCHEMBL2294387

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
	SCHEMBL13228973	0.92	CA12 (0.32)	ESR1ESR2CA12CA9
	SCHEMBL13228983	0.92	CA12 (0.32)	ESR1ESR2CA12CA9
	SCHEMBL13228965	0.91	PSMB5 (0.38)	ESR1ESR2ALDH1A1CYP3A4HPGD
	SCHEMBL13228951	0.90	PSMB5 (0.40)	ESR1ESR2ALDH1A1CYP3A4HPGD
	SCHEMBL13228958	0.89	GSTP1 (0.37)	ESR1ESR2ALDH1A1CYP3A4HPGD
	SCHEMBL13228952	0.89	ESR1 (0.32)	ESR1ESR2TSHR
	SCHEMBL24012571	0.87	ALDH1A1 (0.38)	ESR1ESR2ALDH1A1CYP3A4HPGD
	SCHEMBL7462964	0.87	ALDH1A1 (0.38)	ESR1ESR2ALDH1A1CYP3A4HPGD
	SCHEMBL13228955	0.85	ALDH1A1 (0.34)	ESR1ESR2ALDH1A1CYP3A4HPGD
	SCHEMBL13229011	0.84	ALDH1A1 (0.45)	ESR1ESR2ALDH1A1CYP3A4HPGD

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 11 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.