SCHEMBL1496972

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
	SCHEMBL1496967	0.92	HTR5A (0.40)	NAMPTROCK1HDAC1ALDH1A1PDCD1
	SCHEMBL1497106	0.91	ROCK1 (0.38)	NAMPTROCK1HDAC1PDCD1CD274
	SCHEMBL1497118	0.89	NAMPT (0.45)	NAMPTROCK1ALDH1A1MAPTPDCD1
	SCHEMBL1496854	0.88	HTR5A (0.37)	ROCK1HDAC1ALDH1A1LMNAPDCD1
	SCHEMBL1497071	0.88	ROCK2 (0.39)	NAMPTROCK1HDAC1PDCD1CD274
	SCHEMBL1497029	0.88	ROCK2 (0.42)	ROCK1HDAC1MAPTPDCD1CD274
	SCHEMBL1497000	0.88	CYP3A4 (0.39)	CYP3A4HTTROCK1HDAC1ALDH1A1
	SCHEMBL1496904	0.87	ROCK2 (0.44)	CYP3A4HTTROCK1ALDH1A1ROCK2
	SCHEMBL1496961	0.87	PDCD1 (0.36)	ROCK1HDAC1PDCD1CD274ROCK2
	SCHEMBL7998192	0.86	HTT (0.42)	NAMPTCYP3A4HTTROCK1HDAC1

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 (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.