SCHEMBL1046532

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
	SCHEMBL19262290	1.00	ALOX5 (0.41)	ALOX5PYCR1TRPA1CYP1A2HTT
	SCHEMBL502172	0.88	TRPA1 (0.46)	ALOX5PYCR1TRPA1CYP1A2HTR2A
	SCHEMBL10604704	0.82	ESR1 (0.53)	TRPA1CYP1A2ESR1ESR2SMN1; SMN2
	SCHEMBL28128777	0.82	ACHE (0.47)	ALOX5TRPA1ESR1ESR2
	SCHEMBL28142953	0.82	ACHE (0.47)	ALOX5TRPA1ESR1ESR2
	SCHEMBL28142955	0.82	ACHE (0.47)	ALOX5TRPA1ESR1ESR2
	SCHEMBL17666735	0.82	PYCR1 (0.41)	ALOX5PYCR1CYP1A2HTR2ALMNA
	SCHEMBL1045711	0.80	TRPA1 (0.40)	TRPA1HTT
	SCHEMBL1046531	0.80	ALOX5 (0.41)	ALOX5PYCR1CYP1A2HTR2ASMN1; SMN2
	SCHEMBL13495202	0.80	CYP1A2 (0.41)	ALOX5PYCR1CYP1A2LMNA

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.