SCHEMBL3012816

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
	SCHEMBL3007498	0.89	ALDH1A1 (0.46)	ALDH1A1BRD4ATAD2KDM4EHPGD
	SCHEMBL3803944	0.89	KMT2A (0.41)	ALDH1A1BRD4ATAD2KDM4ENPY5R
	SCHEMBL3007959	0.88	GPR39 (0.47)	ALDH1A1BRD4ATAD2KDM4EHPGD
	SCHEMBL3006049	0.87	ITK (0.43)	ALDH1A1BRD4KDM4EHPGDHSD17B10
	SCHEMBL2998551	0.86	LRRK2 (0.42)	ALDH1A1BRD4ATAD2KDM4EHPGD
	SCHEMBL3416220	0.85	ALDH1A1 (0.40)	ALDH1A1BRD4ATAD2KDM4EHPGD
	SCHEMBL27808493	0.85	NOS2 (0.44)	ALDH1A1KDM4EHPGDHSD17B10NPY5R
	SCHEMBL3003738	0.84	VCP (0.44)	BRD4ATAD2NPY5RITKVCP
	SCHEMBL3009482	0.83	ITK (0.48)	ITKEHMT2
	SCHEMBL3011022	0.78	NPY5R (0.52)	ALDH1A1KDM4EHPGDNPY5RLMNA

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 32 patents — showing the first 20. 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 (4 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.