SCHEMBL16612380

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
	SCHEMBL16612428	0.98	NR1I2 (0.50)	NR1I2TYRALDH1A1ALDH1A3ALDH3A1
	SCHEMBL16612178	0.95	NR1I2 (0.48)	NR1I2TYRALDH1A1ALDH1A3ALDH3A1
	SCHEMBL22563040	0.93	TYR (0.46)	NR1I2TYRALDH1A1ALDH1A3ALDH3A1
	SCHEMBL16612761	0.92	NR1I2 (0.59)	NR1I2TYRALDH1A1ALDH1A3ALDH3A1
	SCHEMBL6000273	0.83	TYR (0.54)	TYRALDH1A1ALDH1A3ALDH3A1CYP2A6
	SCHEMBL3839244	0.83	S1PR2 (0.50)	TYRMAPTS1PR2S1PR1S1PR3
	SCHEMBL16612331	0.83	TYR (0.50)	NR1I2TYRALDH1A1ALDH1A3ALDH3A1
	SCHEMBL12280336	0.83	S1PR2 (0.50)	TYRMAPTS1PR2S1PR1S1PR3
	SCHEMBL5725101	0.81	S1PR2 (0.48)	TYRALDH1A1ALDH1A3ALDH3A1LMNA
	SCHEMBL846594	0.79	TYR (0.53)	TYRALDH1A1ALDH1A3ALDH3A1CYP2A6

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 8 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.