SCHEMBL686130

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
	SCHEMBL666188	0.82	ALDH1A1 (0.55)	TRPA1ALDH1A1NR1I2LMNACYP2C9
	SCHEMBL11589726	0.80	HTT (0.39)	ALDH1A1NR1I2LMNACYP2C9TYR
	SCHEMBL27454682	0.77	ALDH1A1 (0.39)	TRPA1ALDH1A1NR1I2LMNACYP2C9
	SCHEMBL30026979	0.76	ALDH1A1 (0.63)	ALDH1A1NR1I2LMNACYP2C9MIF
	SCHEMBL133971	0.76	ALDH1A1 (0.63)	ALDH1A1NR1I2LMNACYP2C9MIF
	SCHEMBL7879191	0.74	TRPA1 (0.47)	TRPA1ALDH1A1ESR1ESR2PTGS2
	SCHEMBL30135130	0.74	TRPA1 (0.46)	TRPA1ALDH1A1NR1I2LMNACYP2C9
	SCHEMBL7597386	0.74	TRPA1 (0.46)	TRPA1ALDH1A1NR1I2LMNACYP2C9
	SCHEMBL29481306	0.74	MAPK1 (0.48)	ALDH1A1NR1I2LMNACYP2C9MIF
	SCHEMBL80891	0.74	MAPK1 (0.48)	ALDH1A1NR1I2LMNACYP2C9MIF

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 87 patents — showing the first 20. 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.