SCHEMBL1496953

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
	SCHEMBL8004725	0.89	PDCD1 (0.37)	PDCD1CD274ROCK1HDAC2HDAC3
	SCHEMBL1496921	0.87	TRPA1 (0.34)	PDCD1CD274ROCK1HDAC1ROCK2
	SCHEMBL1496903	0.87	PDCD1 (0.38)	PDCD1CD274ROCK1HDAC2HDAC3
	SCHEMBL1482611	0.86	PDCD1 (0.38)	PDCD1CD274ROCK1HDAC2HDAC3
	SCHEMBL1496987	0.85	THRA (0.36)	PDCD1CD274ROCK1HDAC2HDAC3
	SCHEMBL1483172	0.85	HIF1A (0.42)	PDCD1CD274ROCK1HDAC2HDAC3
	SCHEMBL8001655	0.85	HDAC1 (0.43)	ROCK1HDAC2HDAC3HDAC1HDAC10
	SCHEMBL8004129	0.85	ROCK2 (0.40)	PDCD1CD274ROCK1HDAC2HDAC3
	SCHEMBL1496888	0.85	ROCK1 (0.40)	PDCD1CD274ROCK1HDAC2HDAC3
	SCHEMBL1497176	0.85	PDCD1 (0.39)	PDCD1CD274ROCK1HDAC2HDAC3

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 9 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.