SCHEMBL459946

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
	SCHEMBL458612	0.88	SLC22A12 (0.58)	HSD17B2SLC22A12CA12CA1CA2
	SCHEMBL459191	0.85	MRGPRX4 (0.55)	SLC22A12TTR
	SCHEMBL31215374	0.85	MRGPRX4 (0.55)	SLC22A12TTR
	SCHEMBL460237	0.85	HSD17B2 (0.57)	HSD17B2SLC22A12RAB9AHDAC1HDAC8
	SCHEMBL15657613	0.83	HSD17B2 (0.56)	HSD17B2CA12CA1CA2CA7
	SCHEMBL458099	0.81	ALDH1A1 (0.51)	HSD17B2SLC22A12RAB9APOLBPKM
	SCHEMBL1634331	0.79	TDP1 (0.52)	RAB9APOLBPKMTDP1L3MBTL1
	SCHEMBL13568832	0.78	SLC22A12 (0.51)	SLC22A12RAB9AL3MBTL1MEN1MAPT
	SCHEMBL1340275	0.76	HSD17B2 (0.52)	HSD17B2CA12CA1CA2CA7
	SCHEMBL2175971	0.76	CA12 (0.59)	HSD17B2CA12CA1CA2CA7

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 (4 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.