SCHEMBL21565713

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
	SCHEMBL29725194	1.00	ALDH1A1 (0.42)	ALDH1A1POLBTDP1KDM4EROCK1
	SCHEMBL2799913	0.90	KMT2A (0.49)	ALDH1A1KDM4EROCK1KMT2ALPL
	SCHEMBL2801616	0.87	CYP2A13 (0.51)	POLBTDP1KDM4EROCK1KMT2A
	SCHEMBL2800281	0.86	NPC1 (0.42)	ALDH1A1ROCK1KMT2AMEN1LPL
	SCHEMBL18579955	0.86	ROCK1 (0.53)	ALDH1A1POLBTDP1KDM4EROCK1
	SCHEMBL16795211	0.82	POLB (0.46)	ALDH1A1POLBTDP1KDM4EROCK1
	SCHEMBL22532810	0.81	KDM4E (0.49)	ALDH1A1POLBTDP1KDM4EROCK1
	SCHEMBL16795319	0.80	POLB (0.44)	ALDH1A1POLBTDP1KDM4EROCK1
	SCHEMBL16795392	0.79	KDM4E (0.43)	ALDH1A1POLBTDP1KDM4ECHKA
	SCHEMBL429722	0.79	LMNA (0.53)	ALDH1A1KDM4ECHKALPLLIPG

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 20 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 (6 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.