SCHEMBL21799433

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
	SCHEMBL21799368	0.90	NPC1 (0.39)	IRAK4DGAT1IDO1NPC1RAB9A
	SCHEMBL21799389	0.86	NPC1 (0.48)	DGAT1NPC1RAB9AMAPK1SMN1; SMN2
	SCHEMBL21799410	0.80	IRAK4 (0.43)	IRAK4DGAT1NPC1RAB9AMAPK1
	SCHEMBL21799424	0.80	SGMS2 (0.47)	IRAK4KMT2A
	SCHEMBL168289	0.74	DGAT1 (0.45)	IRAK4DGAT1MKNK1MKNK2NPC1
	SCHEMBL21799422	0.73	IRAK4 (0.50)	IRAK4MKNK1MKNK2NPC1RAB9A
	SCHEMBL12800042	0.73	IRAK4 (0.50)	IRAK4MKNK1MKNK2MAPK1CCNA2
	SCHEMBL29050890	0.73	IRAK4 (0.41)	IRAK4DGAT1MKNK1MKNK2NPC1
	SCHEMBL21799423	0.72	SCN9A (0.41)	IRAK4DGAT1MAPK1SMN1; SMN2CCNA2
	SCHEMBL22982440	0.72	IRAK4 (0.44)	IRAK4SMN1; SMN2KMT2A

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 6 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.