SCHEMBL31000596

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
	SCHEMBL31000618	1.00	ESR1 (0.46)	ESR1ESR2PDCD1CD274NR1I2
	SCHEMBL1868711	1.00	ESR1 (0.46)	ESR1ESR2PDCD1CD274NR1I2
	SCHEMBL772054	1.00	ESR1 (0.46)	ESR1ESR2PDCD1CD274NR1I2
	SCHEMBL28399990	1.00	ESR1 (0.46)	ESR1ESR2PDCD1CD274NR1I2
	Hydrochloric Acid SCHEMBL2523736	0.98	ESR1 (0.45)	ESR1ESR2PDCD1CD274NR1I2
	Hydrochloric Acid SCHEMBL15105482	0.98	ESR1 (0.45)	ESR1ESR2PDCD1CD274NR1I2
	SCHEMBL24156377	0.83	DPP4 (0.51)	LMNASLC7A5SRCCYP2D6
	SCHEMBL383452	0.83	DPP4 (0.51)	LMNASLC7A5SRCCYP2D6
	SCHEMBL180086	0.83	DPP4 (0.51)	LMNASLC7A5SRCCYP2D6
	SCHEMBL8882516	0.83	DPP4 (0.51)	LMNASLC7A5SRCCYP2D6

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 1 patent. 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.