SCHEMBL21551769

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
	SCHEMBL28427974	0.83	CES2 (0.51)	POLBDAOCES2CES1KEAP1
	SCHEMBL28406515	0.83	DAO (0.52)	POLBDAOCES2CES1KEAP1
	SCHEMBL29291315	0.79	CES2 (0.50)	POLBDAOCES2CES1KEAP1
	SCHEMBL19707240	0.77	CES2 (0.66)	POLBDAOCES2CES1KEAP1
	SCHEMBL11496475	0.76	ALDH1A1 (0.58)	POLBDAOCES2CES1KEAP1
	SCHEMBL27829554	0.76	DAO (0.52)	POLBDAOCES2CES1KEAP1
	SCHEMBL21555670	0.74	TDP1 (0.57)	DAOCES2CES1RAB9AALDH1A1
	SCHEMBL11266686	0.74	KMT2A (0.50)	POLBCES2CES1KEAP1RAB9A
	SCHEMBL27628035	0.72	POLB (0.59)	POLBDAOCES2CES1KEAP1
	SCHEMBL28782394	0.72	CYP2D6 (0.73)	CES2CES1CYP2D6CYP2C19LMNA

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 6 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 (3 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.