SCHEMBL682633

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
	SCHEMBL2139007	1.00	ABCB1 (0.38)	ABCB1HTR6KHKADRB1SLC6A2
	SCHEMBL2138093	0.91	ABCB1 (0.39)	ABCB1HTR6KHKADRB1SLC6A2
	SCHEMBL873409	0.91	ABCB1 (0.39)	ABCB1HTR6KHKADRB1SLC6A2
	SCHEMBL873475	0.89	ABCB1 (0.41)	ABCB1HTR6KHKADRB1SLC6A2
	SCHEMBL681803	0.89	ABCB1 (0.41)	ABCB1HTR6KHKADRB1SLC6A2
	SCHEMBL682891	0.84	KHK (0.39)	KHKADRB1SLC6A2SLC6A4SLC6A3
	SCHEMBL875241	0.84	KHK (0.39)	KHKADRB1SLC6A2SLC6A4SLC6A3
	SCHEMBL682892	0.84	PDE4A (0.43)	ABCB1HTR6KHKDPP4
	SCHEMBL2140024	0.84	PDE4A (0.43)	ABCB1HTR6KHKDPP4
	Hydrochloric Acid SCHEMBL874611	0.83	KHK (0.38)	KHKADRB1SLC6A2SLC6A4SLC6A3

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 16 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.