SCHEMBL5545139

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
	SCHEMBL5546507	0.77	CYP2A6 (0.48)	NOTUMPGRBACE1TRPA1NPC1
	SCHEMBL5544058	0.77	MAPK1 (0.48)	NPC1L3MBTL1RAB9ASMN1; SMN2NFKB1
	SCHEMBL5545143	0.77	PTPRC (0.41)	PTPRCPTPN1NOTUMPIK3R1PIK3CA
	SCHEMBL15329770	0.73	PTPRC (0.38)	PTPRCPTPN1NOTUMPIK3R1PIK3CA
	SCHEMBL28116695	0.71	PTPRC (0.54)	PTPRCPTPN1NOTUMPIK3R1PIK3CA
	SCHEMBL5540675	0.71	PGR (0.37)	NOTUMPGRTRPA1CYP11B1CYP11B2
	SCHEMBL5543806	0.69	NPC1 (0.35)	NOTUMPGRNPC1RAB9ASMN1; SMN2
	SCHEMBL5539482	0.69	TAAR1 (0.46)	PTPN1NOTUMPGRCYP11B1CYP11B2
	SCHEMBL12856701	0.69	PTPRC (0.56)	PTPRCPTPN1ACMSDBACE1TRPA1
	SCHEMBL2094413	0.69	ALDH1A1 (0.47)	PTPRCPTPN1ACMSDBACE1TRPA1

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 (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.